G4VNR0_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession G4VNR0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 577 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	68	Low	90.1	Very high	227 Å²	227	118.1 Å²	118.1	100%	1.118	59%	0.588	S	S	*	*				0	127.2	0	-79.7	-171.3	-79	0	0	106.8
2	V	84.2	Confident	90.3	Very high	104 Å²	104	119.3 Å²	119.3	63%	0.63	59%	0.591	S	S	*	*			trans	-72.6	137.8	171.1	179.9	0	0	0	0	107	A4 F6 K7	V2-A4 PolarHBondContact O-N 3.27Å; V2-F6 HydrophobicContact CG1-CD1 3.63Å; V2-F6 HydrophobicContact CG1-CE1 4.17Å; V2-K7 HydrophobicContact CG1-CB 4.37Å
3	D	93.7	Very high	90.6	Very high	99 Å²	99	119.1 Å²	119.1	53%	0.529	59%	0.591	S	S	.	*			trans	-57.6	132.8	176.6	174.6	67.8	0	0	0	110.8	E5 F6 K7	D3-E5 WeakPolarHBondContact OD2-CB 3.43Å; D3-E5 PolarHBondContact OD2-N 3.17Å; D3-F6 HydrophobicContact CB-CB 3.78Å; D3-F6 WeakPolarHBondContact O-CB 3.44Å; D3-F6 PolarHBondContact O-N 3.19Å; D3-F6 WeakPolarHBondContact OD2-CB 3.47Å; D3-F6 PolarHBondContact OD2-N 2.79Å; D3-K7 PolarHBondContact O-N 3.47Å
4	A	93.5	Very high	90.8	Very high	80 Å²	80	115.8 Å²	115.8	66%	0.661	57%	0.569	S	S	*	*	H	α-helix	trans	-70	-37.4	-170.8	0	0	0	0	0	111.7	V2 K7 R8	V2-A4 PolarHBondContact O-N 3.27Å; A4-K7 PolarHBondContact O-N 2.85Å; A4-R8 PolarHBondContact O-N 3.37Å
5	E	94.5	Very high	91.1	Very high	129 Å²	129	113.8 Å²	113.8	60%	0.603	56%	0.558	S	S	*	*	H	α-helix	trans	-67.4	-44.2	175.6	-176.5	176.4	-176.9	0	0	110.7	D3 K7 R8 K9	D3-E5 WeakPolarHBondContact OD2-CB 3.43Å; D3-E5 PolarHBondContact OD2-N 3.17Å; E5-K7 VanDerWaalsContact C-N 3.34Å; E5-K7 PolarHBondContact O-N 3.22Å; E5-R8 PolarHBondContact O-N 3.47Å; E5-K9 WeakPolarHBondContact O-CB 3.44Å; E5-K9 PolarHBondContact O-N 3.32Å
6	F	94.5	Very high	91.3	Very high	112 Å²	112	112.3 Å²	112.3	49%	0.491	55%	0.547	S	S	.	.	H	α-helix	trans	-56.1	-46.8	173.2	177.4	-100.5	0	0	0	111.7	V2 D3 R8 L10	V2-F6 HydrophobicContact CG1-CD1 3.63Å; V2-F6 HydrophobicContact CG1-CE1 4.17Å; D3-F6 HydrophobicContact CB-CB 3.78Å; D3-F6 WeakPolarHBondContact O-CB 3.44Å; D3-F6 PolarHBondContact O-N 3.19Å; D3-F6 WeakPolarHBondContact OD2-CB 3.47Å; D3-F6 PolarHBondContact OD2-N 2.79Å; F6-R8 PolarHBondContact O-N 2.95Å; F6-L10 HydrophobicContact CD1-CD1 3.87Å; F6-L10 HydrophobicContact CD1-CG 4.43Å; F6-L10 HydrophobicContact CD2-CG 4.48Å; F6-L10 HydrophobicContact CE1-CD1 3.25Å; F6-L10 HydrophobicContact CE1-CG 4.15Å; F6-L10 HydrophobicContact CE2-CD1 3.99Å; F6-L10 HydrophobicContact CE2-CG 4.17Å; F6-L10 HydrophobicContact CG-CD1 4.48Å; F6-L10 HydrophobicContact CZ-CD1 3.34Å; F6-L10 HydrophobicContact CZ-CG 4.03Å; F6-L10 VanDerWaalsContact O-CB 3.3Å; F6-L10 WeakPolarHBondContact O-CB 3.39Å; F6-L10 WeakPolarHBondContact O-CG 3.16Å; F6-L10 PolarHBondContact O-N 3.23Å
7	K	92.7	Very high	91.6	Very high	127 Å²	127	105.9 Å²	105.9	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-62.3	-43.3	177.2	-174.4	-179.9	177.7	-175.3	0	111.7	V2 D3 A4 E5 N11	V2-K7 HydrophobicContact CG1-CB 4.37Å; D3-K7 PolarHBondContact O-N 3.47Å; A4-K7 PolarHBondContact O-N 2.85Å; E5-K7 VanDerWaalsContact C-N 3.34Å; E5-K7 PolarHBondContact O-N 3.22Å; K7-N11 WeakPolarHBondContact O-CB 3.43Å; K7-N11 VanDerWaalsContact O-CG 3.27Å; K7-N11 PolarHBondContact O-N 3.06Å
8	R	92.5	Very high	91.8	Very high	145 Å²	145	103.8 Å²	103.8	55%	0.547	51%	0.505	S	S	.	.	H	α-helix	trans	-62.7	-52.6	178.3	-174.5	-174.1	65.4	-162.3	-5.9	110.9	A4 E5 F6 L10 N11 E12	A4-R8 PolarHBondContact O-N 3.37Å; E5-R8 PolarHBondContact O-N 3.47Å; F6-R8 PolarHBondContact O-N 2.95Å; R8-L10 VanDerWaalsContact C-N 3.33Å; R8-L10 PolarHBondContact O-N 3.05Å; R8-N11 WeakPolarHBondContact O-CB 3.35Å; R8-N11 PolarHBondContact O-N 3.04Å; R8-E12 WeakPolarHBondContact CG-OE1 3.24Å; R8-E12 IonicContact NE-OE1 3.76Å; R8-E12 WeakPolarHBondContact O-CG 3.41Å; R8-E12 PolarHBondContact O-N 3.28Å
9	K	94.4	Very high	92	Very high	133 Å²	133	103 Å²	103	58%	0.578	50%	0.503	S	S	*	.	H	α-helix	trans	-60.2	-42.2	179.9	-173	173.8	-177.2	174.7	0	112	E5 N11 E12 I13	E5-K9 WeakPolarHBondContact O-CB 3.44Å; E5-K9 PolarHBondContact O-N 3.32Å; K9-N11 VanDerWaalsContact C-N 3.3Å; K9-N11 PolarHBondContact O-N 3.26Å; K9-E12 PolarHBondContact O-N 3.31Å; K9-I13 WeakPolarHBondContact O-CG1 3.41Å; K9-I13 PolarHBondContact O-N 3.33Å; K9-I13 VanDerWaalsContact O-N 3.16Å
10	L	92.6	Very high	92.2	Very high	56 Å²	56	100.1 Å²	100.1	29%	0.293	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-36	174.4	-81.6	-172	0	0	0	112.9	F6 R8 I13 R14	F6-L10 HydrophobicContact CD1-CD1 3.87Å; F6-L10 HydrophobicContact CD1-CG 4.43Å; F6-L10 HydrophobicContact CD2-CG 4.48Å; F6-L10 HydrophobicContact CE1-CD1 3.25Å; F6-L10 HydrophobicContact CE1-CG 4.15Å; F6-L10 HydrophobicContact CE2-CD1 3.99Å; F6-L10 HydrophobicContact CE2-CG 4.17Å; F6-L10 HydrophobicContact CG-CD1 4.48Å; F6-L10 HydrophobicContact CZ-CD1 3.34Å; F6-L10 HydrophobicContact CZ-CG 4.03Å; F6-L10 VanDerWaalsContact O-CB 3.3Å; F6-L10 WeakPolarHBondContact O-CB 3.39Å; F6-L10 WeakPolarHBondContact O-CG 3.16Å; F6-L10 PolarHBondContact O-N 3.23Å; R8-L10 VanDerWaalsContact C-N 3.33Å; R8-L10 PolarHBondContact O-N 3.05Å; L10-I13 HydrophobicContact CD2-CD1 4.22Å; L10-R14 VanDerWaalsContact O-CB 3.22Å; L10-R14 WeakPolarHBondContact O-CB 3.17Å; L10-R14 PolarHBondContact O-N 3.5Å
11	N	90.5	Very high	92.5	Very high	87 Å²	87	95.6 Å²	95.6	47%	0.465	47%	0.468	S	S	.	.	H	α-helix	trans	-71.4	-34.8	177	-76.4	-13.4	0	0	0	112.2	K7 R8 K9	K7-N11 WeakPolarHBondContact O-CB 3.43Å; K7-N11 VanDerWaalsContact O-CG 3.27Å; K7-N11 PolarHBondContact O-N 3.06Å; R8-N11 WeakPolarHBondContact O-CB 3.35Å; R8-N11 PolarHBondContact O-N 3.04Å; K9-N11 VanDerWaalsContact C-N 3.3Å; K9-N11 PolarHBondContact O-N 3.26Å
12	E	92.3	Very high	93.8	Very high	133 Å²	133	88.9 Å²	88.9	62%	0.621	44%	0.436	S	S	*	.	H	α-helix	trans	-66.4	-41.4	177.5	-72.7	165.8	-175.7	0	0	112.3	R8 K9	R8-E12 WeakPolarHBondContact CG-OE1 3.24Å; R8-E12 IonicContact NE-OE1 3.76Å; R8-E12 WeakPolarHBondContact O-CG 3.41Å; R8-E12 PolarHBondContact O-N 3.28Å; K9-E12 PolarHBondContact O-N 3.31Å
13	I	94.2	Very high	94.4	Very high	116 Å²	116	85.1 Å²	85.1	60%	0.595	41%	0.412	S	S	*	.	S	Bend	trans	-88.1	-6.6	-178.5	70.6	178.9	0	0	0	113.8	K9 L10 E15	K9-I13 WeakPolarHBondContact O-CG1 3.41Å; K9-I13 PolarHBondContact O-N 3.33Å; K9-I13 VanDerWaalsContact O-N 3.16Å; L10-I13 HydrophobicContact CD2-CD1 4.22Å; I13-E15 PolarHBondContact O-N 3.24Å
14	R	94.1	Very high	94.3	Very high	73 Å²	73	88 Å²	88	28%	0.275	42%	0.422	S	S	.	.			trans	-74	114.1	-175.2	177.2	174.6	-57.8	-80.3	-8.5	110.3	L10 K16 L87 H89	L10-R14 VanDerWaalsContact O-CB 3.22Å; L10-R14 WeakPolarHBondContact O-CB 3.17Å; L10-R14 PolarHBondContact O-N 3.5Å; R14-K16 PolarHBondContact O-N 3.39Å; R14-L87 PolarHBondContact NH1-O 2.92Å; R14-H89 PolarHBondContact NE-CD2 3.29Å; R14-H89 PolarHBondContact NH1-CD2 2.82Å; R14-H89 PolarHBondContact NH1-NE2 2.94Å; R14-H89 PolarHBondContact NH2-NE2 2.73Å; R14-H89 VanDerWaalsContact NH2-NE2 3.1Å
15	E	95.1	Very high	94.3	Very high	86 Å²	86	87.4 Å²	87.4	40%	0.402	42%	0.424	S	S	.	.			trans	-64.4	125.2	166.4	-67	168.5	133.2	0	0	110.1	I13 L20 R84 F86	I13-E15 PolarHBondContact O-N 3.24Å; E15-L20 HydrophobicContact CB-CD1 3.84Å; E15-L20 HydrophobicContact CG-CD1 4.14Å; E15-R84 VanDerWaalsContact CD-NH1 3.33Å; E15-R84 IonicContact OE1-CZ 2.56Å; E15-R84 IonicContact OE1-NH1 3.96Å; E15-R84 PolarHBondContact OE1-NH1 3.26Å; E15-R84 IonicContact OE1-NH2 3.17Å; E15-R84 PolarHBondContact OE1-NH2 2.52Å; E15-R84 IonicContact OE2-CZ 3.56Å; E15-R84 IonicContact OE2-NE 3.1Å; E15-R84 PolarHBondContact OE2-NE 3.07Å; E15-R84 IonicContact OE2-NH1 3.38Å; E15-R84 PolarHBondContact OE2-NH1 3.43Å; E15-R84 IonicContact OE2-NH2 2.7Å; E15-R84 PolarHBondContact OE2-NH2 3.12Å; E15-F86 HydrophobicContact CB-CD1 4.47Å; E15-F86 HydrophobicContact CB-CE1 4.16Å
16	K	94.8	Very high	94.3	Very high	90 Å²	90	82.7 Å²	82.7	39%	0.391	41%	0.405	S	S	.	.			trans	-102.4	143.8	171.4	-45.2	-162.5	-148.1	86.1	0	109.7	R14 E18 D19 L20	R14-K16 PolarHBondContact O-N 3.39Å; K16-E18 VanDerWaalsContact C-N 3.27Å; K16-E18 HydrophobicContact CB-CG 4.07Å; K16-E18 WeakPolarHBondContact CD-OE1 3.27Å; K16-E18 PolarHBondContact O-N 3.02Å; K16-D19 HydrophobicContact CB-CB 4.23Å; K16-D19 WeakPolarHBondContact CB-OD2 3.4Å; K16-D19 VanDerWaalsContact CG-OD2 3.29Å; K16-D19 WeakPolarHBondContact CG-OD2 3.43Å; K16-D19 IonicContact NZ-OD1 2.68Å; K16-D19 IonicContact NZ-OD2 3.62Å; K16-D19 PolarHBondContact NZ-OD2 2.93Å; K16-D19 PolarHBondContact O-N 3.16Å; K16-D19 VanDerWaalsContact O-N 3.16Å; K16-L20 PolarHBondContact O-N 3.25Å
17	V	96.3	Very high	94.4	Very high	3 Å²	3	78 Å²	78	2%	0.018	38%	0.384	C	S	.	.	H	α-helix	trans	-63.1	-39.9	-178.1	61.9	0	0	0	0	110.7	D19 L20 F21 F23 L52 F86 W95	V17-D19 VanDerWaalsContact C-N 3.28Å; V17-D19 PolarHBondContact O-N 2.75Å; V17-L20 PolarHBondContact O-N 3.11Å; V17-F21 HydrophobicContact CG2-CD2 4.26Å; V17-F21 PolarHBondContact O-N 3.32Å; V17-F23 HydrophobicContact CG2-CE1 4.07Å; V17-L52 HydrophobicContact CG2-CD1 3.43Å; V17-L52 VanDerWaalsContact CG2-CD1 3.43Å; V17-L52 HydrophobicContact CG2-CD2 3.61Å; V17-L52 HydrophobicContact CG2-CG 4.18Å; V17-F86 HydrophobicContact CB-CB 4.21Å; V17-F86 HydrophobicContact CB-CD2 4.07Å; V17-F86 HydrophobicContact CB-CG 4.03Å; V17-F86 HydrophobicContact CG2-CD2 4.19Å; V17-F86 HydrophobicContact CG2-CE2 4.48Å; V17-W95 HydrophobicContact CG1-CD2 4.1Å; V17-W95 HydrophobicContact CG1-CG 4.02Å
18	E	95	Very high	94.4	Very high	68 Å²	68	72.8 Å²	72.8	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-66.4	-25	176.9	60.1	-91.2	-148.4	0	0	113.8	K16 K42	K16-E18 VanDerWaalsContact C-N 3.27Å; K16-E18 HydrophobicContact CB-CG 4.07Å; K16-E18 WeakPolarHBondContact CD-OE1 3.27Å; K16-E18 PolarHBondContact O-N 3.02Å; E18-K42 PolarHBondContact O-NZ 2.9Å
19	D	95.1	Very high	94.3	Very high	89 Å²	89	66.9 Å²	66.9	48%	0.476	35%	0.347	S	S	.	.	H	α-helix	trans	-82.8	-30.4	178.2	-64.6	-23.6	0	0	0	110.8	K16 V17	K16-D19 HydrophobicContact CB-CB 4.23Å; K16-D19 WeakPolarHBondContact CB-OD2 3.4Å; K16-D19 VanDerWaalsContact CG-OD2 3.29Å; K16-D19 WeakPolarHBondContact CG-OD2 3.43Å; K16-D19 IonicContact NZ-OD1 2.68Å; K16-D19 IonicContact NZ-OD2 3.62Å; K16-D19 PolarHBondContact NZ-OD2 2.93Å; K16-D19 PolarHBondContact O-N 3.16Å; K16-D19 VanDerWaalsContact O-N 3.16Å; V17-D19 VanDerWaalsContact C-N 3.28Å; V17-D19 PolarHBondContact O-N 2.75Å
20	L	96.4	Very high	93.9	Very high	44 Å²	44	65.7 Å²	65.7	23%	0.23	34%	0.339	C	S	.	.	H	α-helix	trans	-95.2	-34.2	-174.7	-66.5	-178.2	0	0	0	114.4	E15 K16 V17 K42 F86	E15-L20 HydrophobicContact CB-CD1 3.84Å; E15-L20 HydrophobicContact CG-CD1 4.14Å; K16-L20 PolarHBondContact O-N 3.25Å; V17-L20 PolarHBondContact O-N 3.11Å; L20-K42 PolarHBondContact O-N 3.38Å; L20-F86 HydrophobicContact CD1-CE1 3.81Å; L20-F86 HydrophobicContact CD1-CZ 4.11Å
21	F	97.6	Very high	93.1	Very high	7 Å²	7	64.5 Å²	64.5	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.8	-170.3	-66.9	-87.2	0	0	0	112.4	V17 F23 A39 K40 L41 K42 Y50 L52 F86 L97	V17-F21 HydrophobicContact CG2-CD2 4.26Å; V17-F21 PolarHBondContact O-N 3.32Å; F21-F23 HydrophobicContact CB-CD1 4Å; F21-F23 WeakPolarHBondContact O-CD1 3.23Å; F21-A39 HydrophobicContact CB-CB 4.25Å; F21-A39 HydrophobicContact CD1-CB 4.07Å; F21-A39 HydrophobicContact CG-CB 4.46Å; F21-K40 CarbonylContact C-O 3.56Å; F21-K40 VanDerWaalsContact CA-O 3.26Å; F21-K40 WeakPolarHBondContact CA-O 3.46Å; F21-L41 HydrophobicContact CD1-CD2 4.11Å; F21-L41 HydrophobicContact CD1-CG 4.26Å; F21-L41 HydrophobicContact CE1-CD2 3.54Å; F21-L41 HydrophobicContact CE1-CG 3.71Å; F21-L41 HydrophobicContact CE2-CD2 4.22Å; F21-L41 HydrophobicContact CZ-CD2 3.59Å; F21-L41 HydrophobicContact CZ-CG 4.23Å; F21-K42 VanDerWaalsContact O-CE 3.23Å; F21-K42 WeakPolarHBondContact O-CE 3.45Å; F21-Y50 AromaticContact CE1-CD2 3.85Å; F21-Y50 HydrophobicContact CE1-CD2 3.85Å; F21-Y50 HydrophobicContact CE1-CE2 4.35Å; F21-Y50 AromaticContact CE1-CG 3.95Å; F21-Y50 HydrophobicContact CE1-CG 3.95Å; F21-L52 HydrophobicContact CB-CD1 3.86Å; F21-L52 HydrophobicContact CD2-CD1 4.43Å; F21-L52 HydrophobicContact CG-CD1 4.1Å; F21-F86 HydrophobicContact CE2-CE2 4.04Å; F21-F86 AromaticContact CE2-CZ 3.79Å; F21-F86 HydrophobicContact CE2-CZ 3.79Å; F21-L97 HydrophobicContact CD1-CD1 4.49Å; F21-L97 HydrophobicContact CE1-CD1 3.81Å; F21-L97 HydrophobicContact CE1-CD2 4.39Å; F21-L97 HydrophobicContact CE2-CD1 4.14Å; F21-L97 HydrophobicContact CE2-CD2 4.12Å; F21-L97 HydrophobicContact CZ-CD1 3.63Å; F21-L97 HydrophobicContact CZ-CD2 3.55Å; F21-L97 HydrophobicContact CZ-CG 4.26Å
22	D	96.8	Very high	92.2	Very high	85 Å²	85	64.8 Å²	64.8	46%	0.455	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.8	164.3	-174.8	22.3	0	0	0	109.1	A39 K40 K42	D22-A39 CarbonylContact O-C 3.58Å; D22-A39 VanDerWaalsContact O-CA 3.26Å; D22-A39 WeakPolarHBondContact O-CA 3.11Å; D22-K40 PolarHBondContact N-O 2.67Å; D22-K40 PolarHBondContact O-N 3.17Å; D22-K42 HydrophobicContact CB-CG 4.12Å
23	F	95.9	Very high	91.3	Very high	26 Å²	26	60.4 Å²	60.4	11%	0.114	32%	0.323	C	S	.	.			trans	-150.2	4.3	-175.8	63.8	-92.7	0	0	0	113.2	V17 F21 C26 Y37 A39 L52 W95	V17-F23 HydrophobicContact CG2-CE1 4.07Å; F21-F23 HydrophobicContact CB-CD1 4Å; F21-F23 WeakPolarHBondContact O-CD1 3.23Å; F23-C26 WeakPolarHBondContact O-CB 3.43Å; F23-C26 PolarHBondContact O-N 2.67Å; F23-Y37 HydrophobicContact CD2-CD1 4.09Å; F23-Y37 HydrophobicContact CD2-CG 4.14Å; F23-A39 HydrophobicContact CB-CB 3.91Å; F23-L52 HydrophobicContact CB-CD1 4.22Å; F23-L52 HydrophobicContact CD1-CD1 3.61Å; F23-L52 HydrophobicContact CE1-CD1 4.14Å; F23-L52 HydrophobicContact CG-CD1 3.95Å; F23-W95 HydrophobicContact CD2-CH2 4.5Å; F23-W95 AromaticContact CE2-CH2 3.75Å; F23-W95 HydrophobicContact CE2-CH2 3.75Å; F23-W95 HydrophobicContact CE2-CZ2 4.45Å; F23-W95 HydrophobicContact CE2-CZ3 4.25Å; F23-W95 HydrophobicContact CZ-CH2 4.14Å; F23-W95 HydrophobicContact CZ-CZ2 4.48Å
24	E	92.3	Very high	90.9	Very high	158 Å²	158	55.1 Å²	55.1	74%	0.738	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	136.7	179.5	-66.7	-175.2	176.3	0	0	110.1	C26	E24-C26 PolarHBondContact O-N 3.03Å; E24-C26 PolarHBondContact O-SG 3.06Å
25	G	92.2	Very high	90.8	Very high	68 Å²	68	52 Å²	52	70%	0.701	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	1.6	-174.7	0	0	0	0	0	115.4
26	C	95.4	Very high	90.8	Very high	31 Å²	31	50.1 Å²	50.1	21%	0.209	28%	0.281	C	S	.	.			trans	-103	28.1	-173.5	-61.9	0	0	0	0	113.2	F23 E24 V28 Y37 K38 F360	F23-C26 WeakPolarHBondContact O-CB 3.43Å; F23-C26 PolarHBondContact O-N 2.67Å; E24-C26 PolarHBondContact O-N 3.03Å; E24-C26 PolarHBondContact O-SG 3.06Å; C26-V28 PolarHBondContact O-N 2.84Å; C26-Y37 WeakPolarHBondContact O-CA 3.34Å; C26-K38 HydrophobicContact CB-CB 4.42Å; C26-K38 WeakPolarHBondContact CB-O 3.33Å; C26-K38 PolarHBondContact O-N 3.46Å; C26-F360 HydrophobicContact CB-CD1 4.22Å; C26-F360 HydrophobicContact CB-CE1 3.83Å; C26-F360 HydrophobicContact CB-CZ 4.3Å
27	K	95.7	Very high	90.9	Very high	12 Å²	12	47.2 Å²	47.2	5%	0.052	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	129.1	177.2	-174.6	179.1	-69.3	173.2	0	109.7	Y37 F360 I361 D363	K27-Y37 HydrophobicContact CB-CD1 3.81Å; K27-Y37 HydrophobicContact CB-CE1 3.76Å; K27-Y37 WeakPolarHBondContact CE-OH 3.27Å; K27-Y37 HydrophobicContact CG-CD1 4.4Å; K27-Y37 HydrophobicContact CG-CE1 4.15Å; K27-F360 CarbonylContact O-C 3.59Å; K27-F360 VanDerWaalsContact O-CA 3.26Å; K27-F360 WeakPolarHBondContact O-CA 3.42Å; K27-I361 HydrophobicContact CG-CB 4.48Å; K27-I361 PolarHBondContact O-N 2.87Å; K27-D363 WeakPolarHBondContact CE-OD1 3.38Å; K27-D363 IonicContact NZ-OD1 3.11Å; K27-D363 PolarHBondContact NZ-OD1 2.88Å
28	V	94	Very high	91	Very high	19 Å²	19	48.5 Å²	48.5	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	-11.2	-179.3	-65.8	0	0	0	0	113.3	C26 V36 K38 F100 R358 F360	C26-V28 PolarHBondContact O-N 2.84Å; V28-V36 HydrophobicContact CG2-CB 4.27Å; V28-V36 HydrophobicContact CG2-CG1 3.93Å; V28-V36 WeakPolarHBondContact CG2-O 3.28Å; V28-V36 PolarHBondContact N-O 3.37Å; V28-K38 HydrophobicContact CG1-CB 3.97Å; V28-F100 HydrophobicContact CG1-CE2 4.49Å; V28-F100 HydrophobicContact CG1-CZ 4.46Å; V28-F100 HydrophobicContact CG2-CE2 4.18Å; V28-R358 HydrophobicContact CB-CB 4.41Å; V28-R358 HydrophobicContact CG1-CB 4.23Å; V28-F360 HydrophobicContact CG1-CD1 3.78Å; V28-F360 HydrophobicContact CG1-CE1 3.9Å
29	G	89.1	Confident	91.1	Very high	21 Å²	21	45.3 Å²	45.3	22%	0.216	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	148.1	179.3	0	0	0	0	0	112.8	S35 V36	G29-S35 WeakPolarHBondContact O-CA 3.42Å; G29-V36 PolarHBondContact N-O 3.08Å; G29-V36 PolarHBondContact O-N 3.16Å
30	R	86.1	Confident	91.2	Very high	108 Å²	108	46.7 Å²	46.7	41%	0.408	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.1	171.2	-175	174.9	177.4	178.2	-12.5	108.4	G34 D367	R30-G34 WeakPolarHBondContact CA-O 3.44Å; R30-D367 IonicContact NH1-OD1 3.07Å; R30-D367 IonicContact NH2-OD1 3.39Å
31	G	76.9	Confident	91.2	Very high	31 Å²	31	46.2 Å²	46.2	32%	0.32	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	-172.3	177.8	0	0	0	0	0	111.6	Y33 G34	G31-Y33 PolarHBondContact O-N 3.38Å; G31-Y33 VanDerWaalsContact O-N 3.07Å; G31-G34 PolarHBondContact N-O 3.23Å; G31-G34 PolarHBondContact O-N 2.93Å
32	T	71.9	Confident	91.1	Very high	92 Å²	92	51.4 Å²	51.4	56%	0.564	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.4	-178.9	-44.9	0	0	0	0	113.3
33	Y	72.3	Confident	91	Very high	41 Å²	41	52.3 Å²	52.3	16%	0.161	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-5.6	179.9	-57	-68.4	0	0	0	114.3	G31 E56 D174 F177	G31-Y33 PolarHBondContact O-N 3.38Å; G31-Y33 VanDerWaalsContact O-N 3.07Å; Y33-E56 PolarHBondContact O-N 3.16Å; Y33-E56 VanDerWaalsContact O-N 3.08Å; Y33-D174 WeakPolarHBondContact CD2-OD2 3.29Å; Y33-D174 WeakPolarHBondContact CE2-OD2 3.32Å; Y33-F177 HydrophobicContact CE2-CD2 4.42Å; Y33-F177 AromaticContact CE2-CE2 3.98Å; Y33-F177 HydrophobicContact CE2-CE2 3.98Å; Y33-F177 AromaticContact CZ-CD2 3.9Å; Y33-F177 AromaticContact CZ-CE2 3.55Å; Y33-F177 VanDerWaalsContact OH-CD2 3.3Å; Y33-F177 WeakPolarHBondContact OH-CD2 3.43Å; Y33-F177 WeakPolarHBondContact OH-CE2 3.33Å; Y33-F177 WeakPolarHBondContact OH-CZ 3.23Å
34	G	86.1	Confident	90.7	Very high	5 Å²	5	53.9 Å²	53.9	5%	0.052	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	121	-148.6	177.7	0	0	0	0	0	112.5	R30 G31 Q54	R30-G34 WeakPolarHBondContact CA-O 3.44Å; G31-G34 PolarHBondContact N-O 3.23Å; G31-G34 PolarHBondContact O-N 2.93Å; G34-Q54 WeakPolarHBondContact CA-O 3.39Å
35	S	92	Very high	90.7	Very high	8 Å²	8	51.5 Å²	51.5	6%	0.056	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141.6	-173.7	-62.3	0	0	0	0	111.3	G29 K53 Q54	G29-S35 WeakPolarHBondContact O-CA 3.42Å; S35-K53 CarbonylContact O-C 3.45Å; S35-K53 WeakPolarHBondContact O-CA 3.35Å; S35-Q54 PolarHBondContact N-O 3.22Å; S35-Q54 VanDerWaalsContact N-O 3.07Å; S35-Q54 PolarHBondContact O-N 3.14Å
36	V	95.4	Very high	90.6	Very high	46 Å²	46	50 Å²	50	28%	0.279	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.1	177.2	-176.5	0	0	0	0	109.3	V28 G29 A51 L52 K53	V28-V36 HydrophobicContact CG2-CB 4.27Å; V28-V36 HydrophobicContact CG2-CG1 3.93Å; V28-V36 WeakPolarHBondContact CG2-O 3.28Å; V28-V36 PolarHBondContact N-O 3.37Å; G29-V36 PolarHBondContact N-O 3.08Å; G29-V36 PolarHBondContact O-N 3.16Å; V36-A51 HydrophobicContact CG1-CB 4.28Å; V36-L52 CarbonylContact C-O 3.56Å; V36-L52 WeakPolarHBondContact CA-O 3.41Å; V36-K53 HydrophobicContact CG2-CB 4.28Å; V36-K53 HydrophobicContact CG2-CG 4.15Å
37	Y	97.3	Very high	90.4	Very high	30 Å²	30	54 Å²	54	12%	0.118	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.4	-179.8	-56.5	-101.1	0	0	0	109.8	F23 C26 K27 A51 L52 Q54 W95	F23-Y37 HydrophobicContact CD2-CD1 4.09Å; F23-Y37 HydrophobicContact CD2-CG 4.14Å; C26-Y37 WeakPolarHBondContact O-CA 3.34Å; K27-Y37 HydrophobicContact CB-CD1 3.81Å; K27-Y37 HydrophobicContact CB-CE1 3.76Å; K27-Y37 WeakPolarHBondContact CE-OH 3.27Å; K27-Y37 HydrophobicContact CG-CD1 4.4Å; K27-Y37 HydrophobicContact CG-CE1 4.15Å; Y37-A51 WeakPolarHBondContact O-CA 3.32Å; Y37-L52 PolarHBondContact N-O 3.31Å; Y37-L52 PolarHBondContact O-N 3.48Å; Y37-Q54 HydrophobicContact CE2-CB 4.33Å; Y37-W95 HydrophobicContact CD2-CH2 4.22Å; Y37-W95 AromaticContact CD2-CZ3 3.71Å; Y37-W95 HydrophobicContact CD2-CZ3 3.71Å; Y37-W95 AromaticContact CE2-CH2 3.9Å; Y37-W95 HydrophobicContact CE2-CH2 3.9Å; Y37-W95 AromaticContact CE2-CZ3 3.79Å; Y37-W95 HydrophobicContact CE2-CZ3 3.79Å
38	K	97.3	Very high	90.3	Very high	29 Å²	29	58.7 Å²	58.7	13%	0.126	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.9	163.6	-171.8	172	-173.4	167.3	0	107.6	C26 V28 D49 Y50 F100 E102 F360	C26-K38 HydrophobicContact CB-CB 4.42Å; C26-K38 WeakPolarHBondContact CB-O 3.33Å; C26-K38 PolarHBondContact O-N 3.46Å; V28-K38 HydrophobicContact CG1-CB 3.97Å; K38-D49 WeakPolarHBondContact CE-OD1 3.39Å; K38-D49 WeakPolarHBondContact CE-OD2 2.95Å; K38-D49 IonicContact NZ-OD2 3.05Å; K38-D49 PolarHBondContact NZ-OD2 3.19Å; K38-Y50 CarbonylContact C-O 3.54Å; K38-Y50 WeakPolarHBondContact CA-O 3.36Å; K38-F100 HydrophobicContact CB-CD2 4.2Å; K38-F100 HydrophobicContact CB-CE2 3.68Å; K38-F100 HydrophobicContact CB-CZ 4.07Å; K38-F100 HydrophobicContact CD-CD1 4.29Å; K38-F100 HydrophobicContact CD-CE1 3.74Å; K38-F100 HydrophobicContact CD-CE2 4.01Å; K38-F100 HydrophobicContact CD-CZ 3.59Å; K38-F100 HydrophobicContact CG-CD1 4.43Å; K38-F100 HydrophobicContact CG-CD2 3.93Å; K38-F100 HydrophobicContact CG-CE1 4.2Å; K38-F100 HydrophobicContact CG-CE2 3.69Å; K38-F100 HydrophobicContact CG-CG 4.31Å; K38-F100 HydrophobicContact CG-CZ 3.84Å; K38-E102 IonicContact NZ-OE2 2.66Å; K38-E102 PolarHBondContact NZ-OE2 3.31Å; K38-F360 HydrophobicContact CB-CE1 4.02Å; K38-F360 HydrophobicContact CD-CE1 4.27Å; K38-F360 HydrophobicContact CD-CZ 4.39Å
39	A	97.5	Very high	90.4	Very high	1 Å²	1	60 Å²	60	1%	0.008	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.5	-171.2	0	0	0	0	0	111.6	F21 D22 F23 Y50 L52	F21-A39 HydrophobicContact CB-CB 4.25Å; F21-A39 HydrophobicContact CD1-CB 4.07Å; F21-A39 HydrophobicContact CG-CB 4.46Å; D22-A39 CarbonylContact O-C 3.58Å; D22-A39 VanDerWaalsContact O-CA 3.26Å; D22-A39 WeakPolarHBondContact O-CA 3.11Å; F23-A39 HydrophobicContact CB-CB 3.91Å; A39-Y50 PolarHBondContact N-O 3.39Å; A39-Y50 PolarHBondContact O-N 2.7Å; A39-L52 HydrophobicContact CB-CB 4.49Å; A39-L52 HydrophobicContact CB-CD1 3.63Å; A39-L52 HydrophobicContact CB-CG 3.92Å
40	K	97	Very high	90.8	Very high	119 Å²	119	59.8 Å²	59.8	52%	0.517	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.1	171.2	-70.8	-174.1	173.5	-175.3	0	110.4	F21 D22 D49	F21-K40 CarbonylContact C-O 3.56Å; F21-K40 VanDerWaalsContact CA-O 3.26Å; F21-K40 WeakPolarHBondContact CA-O 3.46Å; D22-K40 PolarHBondContact N-O 2.67Å; D22-K40 PolarHBondContact O-N 3.17Å; K40-D49 WeakPolarHBondContact CE-OD1 3.02Å
41	L	96.6	Very high	91.3	Very high	33 Å²	33	55.2 Å²	55.2	17%	0.173	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.5	173.1	-79.4	162.6	0	0	0	110.3	F21 D43 G44 D46 Y50	F21-L41 HydrophobicContact CD1-CD2 4.11Å; F21-L41 HydrophobicContact CD1-CG 4.26Å; F21-L41 HydrophobicContact CE1-CD2 3.54Å; F21-L41 HydrophobicContact CE1-CG 3.71Å; F21-L41 HydrophobicContact CE2-CD2 4.22Å; F21-L41 HydrophobicContact CZ-CD2 3.59Å; F21-L41 HydrophobicContact CZ-CG 4.23Å; L41-D43 VanDerWaalsContact C-N 3.32Å; L41-D43 PolarHBondContact O-N 2.84Å; L41-G44 PolarHBondContact O-N 3.45Å; L41-D46 HydrophobicContact CD1-CB 3.79Å; L41-Y50 HydrophobicContact CD1-CE2 3.8Å; L41-Y50 HydrophobicContact CG-CE2 4.09Å
42	K	96.1	Very high	92.3	Very high	117 Å²	117	53.8 Å²	53.8	51%	0.509	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-29.3	-178.6	-77.3	-177.9	167	178.3	0	113.3	E18 L20 F21 D22 G44	E18-K42 PolarHBondContact O-NZ 2.9Å; L20-K42 PolarHBondContact O-N 3.38Å; F21-K42 VanDerWaalsContact O-CE 3.23Å; F21-K42 WeakPolarHBondContact O-CE 3.45Å; D22-K42 HydrophobicContact CB-CG 4.12Å; K42-G44 VanDerWaalsContact C-N 3.27Å; K42-G44 PolarHBondContact O-N 3.37Å
43	D	93.6	Very high	93.4	Very high	103 Å²	103	50.2 Å²	50.2	55%	0.551	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.4	-178.5	66.3	10.6	0	0	0	113.7	L41 T45	L41-D43 VanDerWaalsContact C-N 3.32Å; L41-D43 PolarHBondContact O-N 2.84Å; D43-T45 HydrophobicContact CB-CG2 4.15Å; D43-T45 VanDerWaalsContact CG-OG1 3.27Å; D43-T45 PolarHBondContact O-N 3.35Å; D43-T45 WeakPolarHBondContact OD1-CB 3.38Å; D43-T45 WeakPolarHBondContact OD1-CG2 3.28Å; D43-T45 PolarHBondContact OD1-N 3.11Å; D43-T45 PolarHBondContact OD1-OG1 3.47Å; D43-T45 WeakPolarHBondContact OD2-CG2 3.08Å; D43-T45 PolarHBondContact OD2-OG1 3.12Å
44	G	90	Very high	94.4	Very high	59 Å²	59	50 Å²	50	61%	0.608	27%	0.273	S	S	*	.			trans	65.9	11.4	-179.1	0	0	0	0	0	114.7	L41 K42 D46	L41-G44 PolarHBondContact O-N 3.45Å; K42-G44 VanDerWaalsContact C-N 3.27Å; K42-G44 PolarHBondContact O-N 3.37Å; G44-D46 PolarHBondContact O-N 2.89Å
45	T	91.9	Very high	94.6	Very high	109 Å²	109	50.4 Å²	50.4	67%	0.669	27%	0.274	S	S	*	.	S	Bend	trans	-65	-23	179.5	55.9	0	0	0	0	112.6	D43	D43-T45 HydrophobicContact CB-CG2 4.15Å; D43-T45 VanDerWaalsContact CG-OG1 3.27Å; D43-T45 PolarHBondContact O-N 3.35Å; D43-T45 WeakPolarHBondContact OD1-CB 3.38Å; D43-T45 WeakPolarHBondContact OD1-CG2 3.28Å; D43-T45 PolarHBondContact OD1-N 3.11Å; D43-T45 PolarHBondContact OD1-OG1 3.47Å; D43-T45 WeakPolarHBondContact OD2-CG2 3.08Å; D43-T45 PolarHBondContact OD2-OG1 3.12Å
46	D	90.6	Very high	94.2	Very high	35 Å²	35	54.8 Å²	54.8	19%	0.187	29%	0.294	C	S	.	.			trans	-144.3	125.3	179.4	173.8	13.3	0	0	0	109.9	L41 G44 R48 Y50	L41-D46 HydrophobicContact CD1-CB 3.79Å; G44-D46 PolarHBondContact O-N 2.89Å; D46-R48 VanDerWaalsContact C-N 3.29Å; D46-R48 VanDerWaalsContact CG-NE 3.32Å; D46-R48 PolarHBondContact O-N 3.09Å; D46-R48 VanDerWaalsContact OD1-CB 3.3Å; D46-R48 WeakPolarHBondContact OD1-CB 3.37Å; D46-R48 WeakPolarHBondContact OD1-CG 3.32Å; D46-R48 PolarHBondContact OD1-N 3.22Å; D46-R48 IonicContact OD1-NE 2.73Å; D46-R48 PolarHBondContact OD1-NE 2.89Å; D46-R48 VanDerWaalsContact OD1-NE 3.11Å; D46-R48 IonicContact OD2-CZ 3.58Å; D46-R48 IonicContact OD2-NE 3.39Å; D46-R48 PolarHBondContact OD2-NE 3.4Å; D46-R48 IonicContact OD2-NH2 3.01Å; D46-R48 PolarHBondContact OD2-NH2 3.41Å; D46-Y50 PolarHBondContact OD2-OH 3.34Å
47	S	90.7	Very high	93.7	Very high	115 Å²	115	54.1 Å²	54.1	80%	0.804	30%	0.296	S	S	*	.			trans	-84.1	-1.1	-175.3	59.7	0	0	0	0	113.8
48	R	93.4	Very high	93.1	Very high	112 Å²	112	56.8 Å²	56.8	42%	0.423	32%	0.316	S	S	.	.			trans	-64.9	146	178.3	-70.9	-178.8	-65.3	161.1	-2.2	112	D46 Y50 D99	D46-R48 VanDerWaalsContact C-N 3.29Å; D46-R48 VanDerWaalsContact CG-NE 3.32Å; D46-R48 PolarHBondContact O-N 3.09Å; D46-R48 VanDerWaalsContact OD1-CB 3.3Å; D46-R48 WeakPolarHBondContact OD1-CB 3.37Å; D46-R48 WeakPolarHBondContact OD1-CG 3.32Å; D46-R48 PolarHBondContact OD1-N 3.22Å; D46-R48 IonicContact OD1-NE 2.73Å; D46-R48 PolarHBondContact OD1-NE 2.89Å; D46-R48 VanDerWaalsContact OD1-NE 3.11Å; D46-R48 IonicContact OD2-CZ 3.58Å; D46-R48 IonicContact OD2-NE 3.39Å; D46-R48 PolarHBondContact OD2-NE 3.4Å; D46-R48 IonicContact OD2-NH2 3.01Å; D46-R48 PolarHBondContact OD2-NH2 3.41Å; R48-Y50 HydrophobicContact CB-CE2 4.16Å; R48-Y50 PolarHBondContact NH2-OH 2.94Å; R48-Y50 WeakPolarHBondContact O-CD2 3.47Å; R48-D99 IonicContact NH1-OD1 3.74Å
49	D	96.5	Very high	92.5	Very high	46 Å²	46	56.2 Å²	56.2	25%	0.246	32%	0.318	C	S	.	.			trans	-81.4	138.7	167	-68.6	-41	0	0	0	109.7	K38 K40 F100	K38-D49 WeakPolarHBondContact CE-OD1 3.39Å; K38-D49 WeakPolarHBondContact CE-OD2 2.95Å; K38-D49 IonicContact NZ-OD2 3.05Å; K38-D49 PolarHBondContact NZ-OD2 3.19Å; K40-D49 WeakPolarHBondContact CE-OD1 3.02Å; D49-F100 VanDerWaalsContact C-CB 3.44Å; D49-F100 HydrophobicContact CB-CB 3.75Å; D49-F100 HydrophobicContact CB-CD1 4.08Å; D49-F100 HydrophobicContact CB-CG 4.09Å; D49-F100 WeakPolarHBondContact O-CB 3.14Å; D49-F100 PolarHBondContact O-N 2.91Å; D49-F100 VanDerWaalsContact O-N 3.16Å
50	Y	97.5	Very high	91.9	Very high	17 Å²	17	60.6 Å²	60.6	7%	0.067	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	156	177.2	-69.8	-88.4	0	0	0	111.5	F21 K38 A39 L41 D46 R48 L97 F98	F21-Y50 AromaticContact CE1-CD2 3.85Å; F21-Y50 HydrophobicContact CE1-CD2 3.85Å; F21-Y50 HydrophobicContact CE1-CE2 4.35Å; F21-Y50 AromaticContact CE1-CG 3.95Å; F21-Y50 HydrophobicContact CE1-CG 3.95Å; K38-Y50 CarbonylContact C-O 3.54Å; K38-Y50 WeakPolarHBondContact CA-O 3.36Å; A39-Y50 PolarHBondContact N-O 3.39Å; A39-Y50 PolarHBondContact O-N 2.7Å; L41-Y50 HydrophobicContact CD1-CE2 3.8Å; L41-Y50 HydrophobicContact CG-CE2 4.09Å; D46-Y50 PolarHBondContact OD2-OH 3.34Å; R48-Y50 HydrophobicContact CB-CE2 4.16Å; R48-Y50 PolarHBondContact NH2-OH 2.94Å; R48-Y50 WeakPolarHBondContact O-CD2 3.47Å; Y50-L97 HydrophobicContact CD1-CD1 3.85Å; Y50-L97 HydrophobicContact CD1-CD2 4.29Å; Y50-L97 HydrophobicContact CD1-CG 4.08Å; Y50-L97 HydrophobicContact CG-CD1 4.03Å; Y50-F98 WeakPolarHBondContact CA-O 3.25Å
51	A	97.4	Very high	91.1	Very high	12 Å²	12	57.4 Å²	57.4	10%	0.099	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.6	168.2	0	0	0	0	0	109.8	V36 Y37 F98 F100	V36-A51 HydrophobicContact CG1-CB 4.28Å; Y37-A51 WeakPolarHBondContact O-CA 3.32Å; A51-F98 HydrophobicContact CB-CB 4.3Å; A51-F98 PolarHBondContact N-O 3.48Å; A51-F98 PolarHBondContact O-N 3.13Å; A51-F100 HydrophobicContact CB-CD2 3.99Å
52	L	96.8	Very high	90.2	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	111.6	171.5	-81.4	173.6	0	0	0	109.5	V17 F21 F23 V36 Y37 A39 F86 W95 L96 L97	V17-L52 HydrophobicContact CG2-CD1 3.43Å; V17-L52 VanDerWaalsContact CG2-CD1 3.43Å; V17-L52 HydrophobicContact CG2-CD2 3.61Å; V17-L52 HydrophobicContact CG2-CG 4.18Å; F21-L52 HydrophobicContact CB-CD1 3.86Å; F21-L52 HydrophobicContact CD2-CD1 4.43Å; F21-L52 HydrophobicContact CG-CD1 4.1Å; F23-L52 HydrophobicContact CB-CD1 4.22Å; F23-L52 HydrophobicContact CD1-CD1 3.61Å; F23-L52 HydrophobicContact CE1-CD1 4.14Å; F23-L52 HydrophobicContact CG-CD1 3.95Å; V36-L52 CarbonylContact C-O 3.56Å; V36-L52 WeakPolarHBondContact CA-O 3.41Å; Y37-L52 PolarHBondContact N-O 3.31Å; Y37-L52 PolarHBondContact O-N 3.48Å; A39-L52 HydrophobicContact CB-CB 4.49Å; A39-L52 HydrophobicContact CB-CD1 3.63Å; A39-L52 HydrophobicContact CB-CG 3.92Å; L52-F86 HydrophobicContact CD2-CE2 4.42Å; L52-W95 HydrophobicContact CB-CE3 4.11Å; L52-W95 HydrophobicContact CB-CZ3 4.26Å; L52-L96 WeakPolarHBondContact CA-O 3.43Å; L52-L97 HydrophobicContact CD2-CB 4.27Å; L52-L97 HydrophobicContact CD2-CD1 3.67Å; L52-L97 HydrophobicContact CG-CD1 4.08Å
53	K	94.6	Very high	89.2	Confident	18 Å²	18	59.4 Å²	59.4	8%	0.078	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.9	172.8	-176.2	179.5	179.7	-177.6	0	109.1	S35 V36 I55 E67 W95 L96 F98 D174	S35-K53 CarbonylContact O-C 3.45Å; S35-K53 WeakPolarHBondContact O-CA 3.35Å; V36-K53 HydrophobicContact CG2-CB 4.28Å; V36-K53 HydrophobicContact CG2-CG 4.15Å; K53-I55 HydrophobicContact CD-CD1 4.12Å; K53-I55 HydrophobicContact CG-CD1 4.22Å; K53-E67 IonicContact NZ-OE1 2.94Å; K53-E67 PolarHBondContact NZ-OE1 3.26Å; K53-E67 IonicContact NZ-OE2 3.92Å; K53-E67 PolarHBondContact NZ-OE2 3.16Å; K53-W95 CarbonylContact O-C 3.03Å; K53-W95 WeakPolarHBondContact O-CA 3.46Å; K53-L96 HydrophobicContact CB-CB 4.35Å; K53-L96 PolarHBondContact N-O 3.34Å; K53-L96 PolarHBondContact O-N 3.13Å; K53-F98 HydrophobicContact CB-CE2 3.99Å; K53-F98 HydrophobicContact CD-CE2 4.48Å; K53-D174 IonicContact NZ-OD1 2.73Å; K53-D174 PolarHBondContact NZ-OD1 3.01Å
54	Q	93.8	Very high	88.7	Confident	37 Å²	37	54.6 Å²	54.6	17%	0.173	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	119	165.8	-168.9	-179.6	52	0	0	108.5	G34 S35 Y37 W95	G34-Q54 WeakPolarHBondContact CA-O 3.39Å; S35-Q54 PolarHBondContact N-O 3.22Å; S35-Q54 VanDerWaalsContact N-O 3.07Å; S35-Q54 PolarHBondContact O-N 3.14Å; Y37-Q54 HydrophobicContact CE2-CB 4.33Å; Q54-W95 HydrophobicContact CB-CD2 3.98Å; Q54-W95 HydrophobicContact CB-CE3 3.66Å; Q54-W95 HydrophobicContact CB-CH2 3.8Å; Q54-W95 HydrophobicContact CB-CZ2 4.11Å; Q54-W95 HydrophobicContact CB-CZ3 3.57Å; Q54-W95 HydrophobicContact CG-CD2 4.08Å; Q54-W95 HydrophobicContact CG-CE3 4.25Å; Q54-W95 HydrophobicContact CG-CH2 4.04Å; Q54-W95 HydrophobicContact CG-CZ2 3.86Å; Q54-W95 HydrophobicContact CG-CZ3 4.25Å
55	I	89.8	Confident	88.5	Confident	12 Å²	12	54.3 Å²	54.3	6%	0.062	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	137.4	177.3	-57.2	-63.6	0	0	0	110.3	K53 A64 V94 L96	K53-I55 HydrophobicContact CD-CD1 4.12Å; K53-I55 HydrophobicContact CG-CD1 4.22Å; I55-A64 HydrophobicContact CG2-CB 3.96Å; I55-V94 HydrophobicContact CB-CB 4.3Å; I55-V94 HydrophobicContact CG1-CB 4.28Å; I55-V94 HydrophobicContact CG1-CG1 4.2Å; I55-V94 PolarHBondContact N-O 3.05Å; I55-L96 HydrophobicContact CD1-CD1 3.86Å; I55-L96 HydrophobicContact CD1-CG 4.23Å; I55-L96 HydrophobicContact CG1-CD1 4.42Å; I55-L96 HydrophobicContact CG1-CG 4.32Å
56	E	84.5	Confident	88.1	Confident	101 Å²	101	51.2 Å²	51.2	47%	0.472	29%	0.288	S	S	.	.	S	Bend	trans	-59.6	145.4	177.7	-168.1	50.8	-118.5	0	0	112.5	Y33	Y33-E56 PolarHBondContact O-N 3.16Å; Y33-E56 VanDerWaalsContact O-N 3.08Å
57	G	84.7	Confident	87.8	Confident	32 Å²	32	49.9 Å²	49.9	33%	0.33	28%	0.281	S	S	.	.	S	Bend	trans	73.8	-166.7	-177.6	0	0	0	0	0	115.2	R93	G57-R93 WeakPolarHBondContact O-CD 3.41Å; G57-R93 PolarHBondContact O-NH1 3.2Å
58	T	85.1	Confident	87.8	Confident	86 Å²	86	45.3 Å²	45.3	53%	0.528	25%	0.247	S	C	.	.	S	Bend	trans	-122.5	143.4	-176.6	62.6	0	0	0	0	111.6
59	G	84.2	Confident	87.6	Confident	17 Å²	17	42.7 Å²	42.7	18%	0.175	25%	0.25	C	S	.	.	S	Bend	trans	81.4	-171.8	-176.4	0	0	0	0	0	112.7	R92	G59-R92 PolarHBondContact N-O 3.31Å
60	L	84.1	Confident	87.4	Confident	93 Å²	93	41.1 Å²	41.1	49%	0.487	24%	0.242	S	C	.	.			trans	-94.2	96.2	176.9	-72.5	166.7	0	0	0	108.9	I68 L87 V94	L60-I68 HydrophobicContact CD2-CD1 3.98Å; L60-L87 HydrophobicContact CD2-CD2 4.34Å; L60-V94 HydrophobicContact CD2-CG1 4.32Å; L60-V94 HydrophobicContact CD2-CG2 3.79Å; L60-V94 HydrophobicContact CG-CG2 4.32Å
61	S	81.8	Confident	87.1	Confident	52 Å²	52	40.5 Å²	40.5	36%	0.364	24%	0.24	S	C	.	.			trans	-66.2	158.4	171.5	71.6	0	0	0	0	110.5	S63 A64 C65	S61-S63 PolarHBondContact O-N 3.29Å; S61-S63 VanDerWaalsContact O-N 3.15Å; S61-A64 WeakPolarHBondContact O-CB 3.44Å; S61-A64 PolarHBondContact O-N 3.3Å; S61-A64 WeakPolarHBondContact OG-CB 3.19Å; S61-A64 PolarHBondContact OG-N 2.95Å; S61-A64 VanDerWaalsContact OG-N 3.08Å; S61-C65 PolarHBondContact O-N 3.41Å
62	M	77	Confident	87	Confident	152 Å²	152	48.5 Å²	48.5	75%	0.749	27%	0.267	S	S	*	.	H	α-helix	trans	-55.7	-33.2	174.9	-74.7	-60.3	-65.6	0	0	112.3	R66	M62-R66 VanDerWaalsContact O-CB 3.29Å; M62-R66 WeakPolarHBondContact O-CB 3.19Å; M62-R66 PolarHBondContact O-N 2.89Å; M62-R66 VanDerWaalsContact O-N 3.16Å
63	S	75.7	Confident	86.8	Confident	40 Å²	40	56 Å²	56	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-69.2	-44.7	174.1	-65	0	0	0	0	112.2	S61 R66 E67	S61-S63 PolarHBondContact O-N 3.29Å; S61-S63 VanDerWaalsContact O-N 3.15Å; S63-R66 PolarHBondContact O-N 3.36Å; S63-R66 PolarHBondContact OG-NH2 3.24Å; S63-R66 VanDerWaalsContact OG-NH2 3.13Å; S63-E67 WeakPolarHBondContact O-CB 3.47Å; S63-E67 PolarHBondContact O-N 3.46Å
64	A	81.9	Confident	86.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-46.6	176.8	0	0	0	0	0	112.2	I55 S61 R66 E67 I68	I55-A64 HydrophobicContact CG2-CB 3.96Å; S61-A64 WeakPolarHBondContact O-CB 3.44Å; S61-A64 PolarHBondContact O-N 3.3Å; S61-A64 WeakPolarHBondContact OG-CB 3.19Å; S61-A64 PolarHBondContact OG-N 2.95Å; S61-A64 VanDerWaalsContact OG-N 3.08Å; A64-R66 VanDerWaalsContact C-N 3.3Å; A64-R66 PolarHBondContact O-N 3.3Å; A64-E67 PolarHBondContact O-N 3.16Å; A64-I68 WeakPolarHBondContact O-CB 3.45Å; A64-I68 VanDerWaalsContact O-CG1 3.28Å; A64-I68 WeakPolarHBondContact O-CG1 3.28Å; A64-I68 PolarHBondContact O-N 3.01Å
65	C	85.5	Confident	86.9	Confident	54 Å²	54	62.5 Å²	62.5	37%	0.365	33%	0.33	S	S	.	.	H	α-helix	trans	-56.2	-46.3	176.2	-77.5	0	0	0	0	111.5	S61 A69	S61-C65 PolarHBondContact O-N 3.41Å; C65-A69 VanDerWaalsContact O-CB 3.23Å; C65-A69 WeakPolarHBondContact O-CB 3.13Å; C65-A69 PolarHBondContact O-N 3.39Å
66	R	84.1	Confident	87.3	Confident	43 Å²	43	63.4 Å²	63.4	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-67.5	-44.7	-179.6	-179.3	-178.5	60.5	-113.2	-1.8	111.9	M62 S63 A64 I68 A69 L70 G176 A178 R179	M62-R66 VanDerWaalsContact O-CB 3.29Å; M62-R66 WeakPolarHBondContact O-CB 3.19Å; M62-R66 PolarHBondContact O-N 2.89Å; M62-R66 VanDerWaalsContact O-N 3.16Å; S63-R66 PolarHBondContact O-N 3.36Å; S63-R66 PolarHBondContact OG-NH2 3.24Å; S63-R66 VanDerWaalsContact OG-NH2 3.13Å; A64-R66 VanDerWaalsContact C-N 3.3Å; A64-R66 PolarHBondContact O-N 3.3Å; R66-I68 VanDerWaalsContact C-N 3.34Å; R66-I68 PolarHBondContact O-N 2.95Å; R66-A69 PolarHBondContact O-N 2.82Å; R66-L70 HydrophobicContact CG-CD1 4.05Å; R66-L70 HydrophobicContact CG-CG 4.42Å; R66-L70 WeakPolarHBondContact O-CB 3.07Å; R66-L70 WeakPolarHBondContact O-CG 3.44Å; R66-L70 PolarHBondContact O-N 3.39Å; R66-G176 PolarHBondContact NH2-O 3.27Å; R66-A178 VanDerWaalsContact CD-O 3.3Å; R66-A178 WeakPolarHBondContact CD-O 2.99Å; R66-A178 PolarHBondContact NE-O 3.39Å; R66-R179 VanDerWaalsContact NH1-CZ 3.32Å
67	E	84.7	Confident	87.9	Confident	7 Å²	7	61.4 Å²	61.4	3%	0.033	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-47	177.2	-178.2	171.7	-167.8	0	0	110.5	K53 S63 A64 L70 L71 L96	K53-E67 IonicContact NZ-OE1 2.94Å; K53-E67 PolarHBondContact NZ-OE1 3.26Å; K53-E67 IonicContact NZ-OE2 3.92Å; K53-E67 PolarHBondContact NZ-OE2 3.16Å; S63-E67 WeakPolarHBondContact O-CB 3.47Å; S63-E67 PolarHBondContact O-N 3.46Å; A64-E67 PolarHBondContact O-N 3.16Å; E67-L70 PolarHBondContact O-N 2.81Å; E67-L71 HydrophobicContact CG-CD1 3.61Å; E67-L71 HydrophobicContact CG-CG 4.43Å; E67-L71 VanDerWaalsContact O-CB 3.3Å; E67-L71 WeakPolarHBondContact O-CB 3.32Å; E67-L71 VanDerWaalsContact O-CG 3.29Å; E67-L71 WeakPolarHBondContact O-CG 3.49Å; E67-L71 PolarHBondContact O-N 2.98Å; E67-L96 HydrophobicContact CG-CD1 4.24Å
68	I	90	Very high	88.6	Confident	19 Å²	19	60.2 Å²	60.2	10%	0.097	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-46.3	175.6	-67.7	165	0	0	0	111.4	L60 A64 R66 L70 R72 V85 V94 L96	L60-I68 HydrophobicContact CD2-CD1 3.98Å; A64-I68 WeakPolarHBondContact O-CB 3.45Å; A64-I68 VanDerWaalsContact O-CG1 3.28Å; A64-I68 WeakPolarHBondContact O-CG1 3.28Å; A64-I68 PolarHBondContact O-N 3.01Å; R66-I68 VanDerWaalsContact C-N 3.34Å; R66-I68 PolarHBondContact O-N 2.95Å; I68-L70 PolarHBondContact O-N 2.99Å; I68-R72 HydrophobicContact CG2-CG 4.35Å; I68-R72 WeakPolarHBondContact O-CB 2.92Å; I68-R72 VanDerWaalsContact O-CG 3.24Å; I68-R72 WeakPolarHBondContact O-CG 3.49Å; I68-R72 PolarHBondContact O-N 2.6Å; I68-R72 VanDerWaalsContact O-N 3.08Å; I68-V85 HydrophobicContact CD1-CG1 4.13Å; I68-V85 HydrophobicContact CG1-CG2 4.41Å; I68-V85 HydrophobicContact CG2-CG2 4.17Å; I68-V94 HydrophobicContact CD1-CG1 3.98Å; I68-L96 HydrophobicContact CD1-CD2 4.02Å; I68-L96 HydrophobicContact CG1-CD2 3.63Å
69	A	90.9	Very high	89.2	Confident	58 Å²	58	56.1 Å²	56.1	48%	0.479	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-42.2	-178.2	0	0	0	0	0	112.1	C65 R66	C65-A69 VanDerWaalsContact O-CB 3.23Å; C65-A69 WeakPolarHBondContact O-CB 3.13Å; C65-A69 PolarHBondContact O-N 3.39Å; R66-A69 PolarHBondContact O-N 2.82Å
70	L	90.4	Very high	89.8	Confident	13 Å²	13	56.4 Å²	56.4	7%	0.068	29%	0.288	C	S	.	.	H	α-helix	trans	-68.4	-53.8	176.7	-67.6	175.7	0	0	0	111.1	R66 E67 I68 R72 E73 L74 I148 A178 L180	R66-L70 HydrophobicContact CG-CD1 4.05Å; R66-L70 HydrophobicContact CG-CG 4.42Å; R66-L70 WeakPolarHBondContact O-CB 3.07Å; R66-L70 WeakPolarHBondContact O-CG 3.44Å; R66-L70 PolarHBondContact O-N 3.39Å; E67-L70 PolarHBondContact O-N 2.81Å; I68-L70 PolarHBondContact O-N 2.99Å; L70-R72 PolarHBondContact O-N 2.94Å; L70-R72 VanDerWaalsContact O-N 3.13Å; L70-E73 PolarHBondContact O-N 3.05Å; L70-L74 HydrophobicContact CB-CD1 4.32Å; L70-L74 VanDerWaalsContact O-CG 3.27Å; L70-L74 WeakPolarHBondContact O-CG 3.29Å; L70-L74 PolarHBondContact O-N 2.79Å; L70-L74 VanDerWaalsContact O-N 3.17Å; L70-I148 HydrophobicContact CD2-CD1 3.91Å; L70-I148 HydrophobicContact CD2-CG1 4.03Å; L70-A178 HydrophobicContact CD1-CB 3.68Å; L70-L180 HydrophobicContact CD2-CD1 4.28Å; L70-L180 HydrophobicContact CD2-CD2 4.13Å; L70-L180 HydrophobicContact CD2-CG 3.96Å
71	L	93	Very high	90.4	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-23.5	-174.6	-73.7	169	0	0	0	113.9	E67 E73 I80 L82 L96 F98 L175	E67-L71 HydrophobicContact CG-CD1 3.61Å; E67-L71 HydrophobicContact CG-CG 4.43Å; E67-L71 VanDerWaalsContact O-CB 3.3Å; E67-L71 WeakPolarHBondContact O-CB 3.32Å; E67-L71 VanDerWaalsContact O-CG 3.29Å; E67-L71 WeakPolarHBondContact O-CG 3.49Å; E67-L71 PolarHBondContact O-N 2.98Å; L71-E73 VanDerWaalsContact C-N 3.35Å; L71-I80 HydrophobicContact CD2-CG2 3.92Å; L71-L82 HydrophobicContact CB-CB 3.71Å; L71-L82 HydrophobicContact CB-CD2 3.92Å; L71-L82 HydrophobicContact CB-CG 4.45Å; L71-L82 HydrophobicContact CD1-CB 4.42Å; L71-L96 HydrophobicContact CD1-CD1 4.49Å; L71-F98 HydrophobicContact CD1-CE1 3.89Å; L71-F98 HydrophobicContact CD1-CZ 3.94Å; L71-L175 HydrophobicContact CD2-CD1 3.66Å; L71-L175 HydrophobicContact CD2-CG 4.39Å; L71-L175 HydrophobicContact CG-CD1 4.19Å
72	R	93.8	Very high	91.1	Very high	180 Å²	180	52.7 Å²	52.7	68%	0.679	27%	0.266	S	S	*	.	H	α-helix	trans	-69	-31.2	174.5	-81.8	-175	128.7	177.8	-3.5	113.7	I68 L70 L82	I68-R72 HydrophobicContact CG2-CG 4.35Å; I68-R72 WeakPolarHBondContact O-CB 2.92Å; I68-R72 VanDerWaalsContact O-CG 3.24Å; I68-R72 WeakPolarHBondContact O-CG 3.49Å; I68-R72 PolarHBondContact O-N 2.6Å; I68-R72 VanDerWaalsContact O-N 3.08Å; L70-R72 PolarHBondContact O-N 2.94Å; L70-R72 VanDerWaalsContact O-N 3.13Å; R72-L82 HydrophobicContact CG-CD2 4.01Å
73	E	93.3	Very high	92	Very high	158 Å²	158	49.7 Å²	49.7	74%	0.738	25%	0.25	S	S	*	.	H	α-helix	trans	-94.6	-19.8	-177.9	-57.5	-55.7	133.4	0	0	112.3	L70 L71	L70-E73 PolarHBondContact O-N 3.05Å; L71-E73 VanDerWaalsContact C-N 3.35Å
74	L	94.6	Very high	92.9	Very high	10 Å²	10	53 Å²	53	5%	0.052	26%	0.257	C	S	.	.			trans	-80.7	129.6	-176.4	-65.4	170.1	0	0	0	112.4	L70 V79 Y142 L143 I148 L175	L70-L74 HydrophobicContact CB-CD1 4.32Å; L70-L74 VanDerWaalsContact O-CG 3.27Å; L70-L74 WeakPolarHBondContact O-CG 3.29Å; L70-L74 PolarHBondContact O-N 2.79Å; L70-L74 VanDerWaalsContact O-N 3.17Å; L74-V79 HydrophobicContact CD1-CG1 4.38Å; L74-Y142 HydrophobicContact CB-CE1 4.29Å; L74-Y142 HydrophobicContact CD2-CD1 4.46Å; L74-Y142 HydrophobicContact CD2-CE1 3.51Å; L74-Y142 HydrophobicContact CG-CE1 4.48Å; L74-L143 HydrophobicContact CD1-CD2 3.88Å; L74-L143 HydrophobicContact CD2-CD2 3.91Å; L74-I148 HydrophobicContact CD1-CD1 4.14Å; L74-I148 HydrophobicContact CD2-CD1 3.52Å; L74-I148 HydrophobicContact CG-CD1 4.21Å; L74-L175 HydrophobicContact CD1-CD1 3.45Å; L74-L175 VanDerWaalsContact CD1-CD1 3.45Å
75	K	96.1	Very high	93.6	Very high	181 Å²	181	55 Å²	55	79%	0.787	27%	0.269	S	S	*	.			trans	-144.9	97.3	177	-171.3	175.4	-177.2	176.6	0	110.5	Y142	K75-Y142 PolarHBondContact N-OH 2.93Å
76	H	98	Very high	94.1	Very high	30 Å²	30	52.8 Å²	52.8	14%	0.139	25%	0.253	C	S	.	.			trans	-150.5	141	178.3	-175.8	-95.3	0	0	0	110.4	N78 V79 N138 Y142	H76-N78 PolarHBondContact ND1-N 3.26Å; H76-N78 PolarHBondContact O-N 3.08Å; H76-N78 VanDerWaalsContact O-N 3.09Å; H76-V79 HydrophobicContact CB-CB 4.24Å; H76-V79 HydrophobicContact CB-CG2 4.08Å; H76-V79 PolarHBondContact O-N 3.09Å; H76-V79 VanDerWaalsContact O-N 3.12Å; H76-V79 VanDerWaalsContact O-O 3.13Å; H76-N138 PolarHBondContact CE1-ND2 3.22Å; H76-N138 VanDerWaalsContact CE1-ND2 3.26Å; H76-N138 PolarHBondContact CE1-O 3.43Å; H76-N138 PolarHBondContact NE2-ND2 2.96Å; H76-Y142 HydrophobicContact CB-CD1 3.4Å; H76-Y142 VanDerWaalsContact CB-CD1 3.4Å; H76-Y142 HydrophobicContact CB-CD2 4.06Å; H76-Y142 HydrophobicContact CB-CE1 3.59Å; H76-Y142 HydrophobicContact CB-CE2 4.24Å; H76-Y142 HydrophobicContact CB-CG 3.65Å; H76-Y142 AromaticContact CD2-CD2 3.86Å; H76-Y142 AromaticContact CD2-CG 3.65Å; H76-Y142 AromaticContact CG-CD1 3.84Å; H76-Y142 AromaticContact CG-CG 3.65Å
77	P	97.9	Very high	94.6	Very high	60 Å²	60	54 Å²	54	39%	0.39	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.7	-178.4	19.8	-34.2	0	0	0	113.7	R169 K171	P77-R169 VanDerWaalsContact O-CD 3.26Å; P77-R169 WeakPolarHBondContact O-CD 3.35Å; P77-K171 WeakPolarHBondContact O-CD 3.44Å; P77-K171 PolarHBondContact O-NZ 3.21Å
78	N	98.6	Very high	95	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.032	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	12.7	-178.2	-54.3	117.5	0	0	0	115.9	H76 Q135 N138 V170 I172	H76-N78 PolarHBondContact ND1-N 3.26Å; H76-N78 PolarHBondContact O-N 3.08Å; H76-N78 VanDerWaalsContact O-N 3.09Å; N78-Q135 VanDerWaalsContact CB-O 3.3Å; N78-Q135 WeakPolarHBondContact CB-O 3.49Å; N78-Q135 PolarHBondContact ND2-OE1 3.22Å; N78-N138 PolarHBondContact OD1-ND2 3.15Å; N78-V170 VanDerWaalsContact CA-O 3.24Å; N78-V170 WeakPolarHBondContact CA-O 3.47Å; N78-V170 PolarHBondContact ND2-O 2.99Å; N78-V170 VanDerWaalsContact ND2-O 3.08Å; N78-I172 WeakPolarHBondContact O-CB 3.39Å; N78-I172 WeakPolarHBondContact O-CG1 3.47Å; N78-I172 PolarHBondContact O-N 3.29Å
79	V	98	Very high	94.9	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-118.4	142.2	170.6	179.3	0	0	0	0	107.9	L74 H76 T81 Y142 L143	L74-V79 HydrophobicContact CD1-CG1 4.38Å; H76-V79 HydrophobicContact CB-CB 4.24Å; H76-V79 HydrophobicContact CB-CG2 4.08Å; H76-V79 PolarHBondContact O-N 3.09Å; H76-V79 VanDerWaalsContact O-N 3.12Å; H76-V79 VanDerWaalsContact O-O 3.13Å; V79-T81 PolarHBondContact O-N 3.01Å; V79-Y142 HydrophobicContact CG2-CD1 3.98Å; V79-L143 HydrophobicContact CG1-CD2 4.25Å; V79-L143 HydrophobicContact CG2-CD2 3.98Å; V79-L143 HydrophobicContact CG2-CG 4.12Å
80	I	96.8	Very high	94.8	Very high	22 Å²	22	63.3 Å²	63.3	11%	0.113	31%	0.305	C	S	.	.			trans	-63.1	134.7	178.5	-160.1	172.8	0	0	0	110.8	L71 F98 L159 K171 I172	L71-I80 HydrophobicContact CD2-CG2 3.92Å; I80-F98 HydrophobicContact CD1-CB 3.99Å; I80-F98 HydrophobicContact CD1-CD1 3.75Å; I80-F98 HydrophobicContact CD1-CD2 4.48Å; I80-F98 HydrophobicContact CD1-CE1 4.33Å; I80-F98 HydrophobicContact CD1-CG 3.83Å; I80-F98 HydrophobicContact CG1-CB 4.26Å; I80-F98 HydrophobicContact CG1-CD1 3.72Å; I80-F98 HydrophobicContact CG1-CE1 4.38Å; I80-F98 HydrophobicContact CG1-CG 4.2Å; I80-F98 HydrophobicContact CG2-CD1 4.49Å; I80-F98 HydrophobicContact CG2-CE1 4.33Å; I80-L159 HydrophobicContact CD1-CD1 3.89Å; I80-K171 HydrophobicContact CB-CB 4.46Å; I80-I172 WeakPolarHBondContact CB-O 3.11Å; I80-I172 WeakPolarHBondContact CG2-O 3.33Å; I80-I172 PolarHBondContact N-O 2.84Å
81	T	96	Very high	94.8	Very high	46 Å²	46	66 Å²	66	28%	0.282	32%	0.323	S	S	.	.			trans	-102	121.9	-176.3	-54.2	0	0	0	0	110.5	V79 Q83 F98	V79-T81 PolarHBondContact O-N 3.01Å; T81-Q83 PolarHBondContact O-N 3.12Å; T81-F98 WeakPolarHBondContact O-CD1 3.38Å
82	L	96.6	Very high	94.8	Very high	22 Å²	22	73.1 Å²	73.1	12%	0.115	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	114.7	172.3	175.8	67.8	0	0	0	110	L71 R72 R84 V85 L96 F98	L71-L82 HydrophobicContact CB-CB 3.71Å; L71-L82 HydrophobicContact CB-CD2 3.92Å; L71-L82 HydrophobicContact CB-CG 4.45Å; L71-L82 HydrophobicContact CD1-CB 4.42Å; R72-L82 HydrophobicContact CG-CD2 4.01Å; L82-R84 WeakPolarHBondContact CD1-O 3.33Å; L82-V85 HydrophobicContact CD1-CG2 4.21Å; L82-V85 HydrophobicContact CD2-CG2 3.77Å; L82-V85 HydrophobicContact CG-CG2 4.32Å; L82-L96 HydrophobicContact CD1-CB 3.78Å; L82-L96 HydrophobicContact CD1-CD2 4.06Å; L82-L96 HydrophobicContact CD1-CG 4.36Å; L82-F98 HydrophobicContact CB-CE1 4.03Å; L82-F98 HydrophobicContact CD1-CE1 3.97Å; L82-F98 HydrophobicContact CD1-CZ 4.05Å
83	Q	95.7	Very high	94.8	Very high	88 Å²	88	68 Å²	68	41%	0.411	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-44.1	179.4	-61.1	-64.2	-12.9	0	0	111.2	T81 L97 D99	T81-Q83 PolarHBondContact O-N 3.12Å; Q83-L97 HydrophobicContact CB-CB 4.35Å; Q83-L97 HydrophobicContact CB-CD2 4.02Å; Q83-L97 HydrophobicContact CB-CG 4.09Å; Q83-L97 WeakPolarHBondContact CB-O 3.48Å; Q83-L97 PolarHBondContact N-O 3.34Å; Q83-D99 PolarHBondContact NE2-OD2 3.32Å
84	R	96	Very high	94.8	Very high	110 Å²	110	60.8 Å²	60.8	42%	0.415	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	156.3	-175.9	-140.3	164.3	-158.4	178.2	0	112.9	E15 L82 F86 L97	E15-R84 VanDerWaalsContact CD-NH1 3.33Å; E15-R84 IonicContact OE1-CZ 2.56Å; E15-R84 IonicContact OE1-NH1 3.96Å; E15-R84 PolarHBondContact OE1-NH1 3.26Å; E15-R84 IonicContact OE1-NH2 3.17Å; E15-R84 PolarHBondContact OE1-NH2 2.52Å; E15-R84 IonicContact OE2-CZ 3.56Å; E15-R84 IonicContact OE2-NE 3.1Å; E15-R84 PolarHBondContact OE2-NE 3.07Å; E15-R84 IonicContact OE2-NH1 3.38Å; E15-R84 PolarHBondContact OE2-NH1 3.43Å; E15-R84 IonicContact OE2-NH2 2.7Å; E15-R84 PolarHBondContact OE2-NH2 3.12Å; L82-R84 WeakPolarHBondContact CD1-O 3.33Å; R84-F86 HydrophobicContact CB-CE2 4.09Å; R84-F86 HydrophobicContact CB-CZ 4.11Å; R84-F86 HydrophobicContact CG-CE1 4.42Å; R84-F86 HydrophobicContact CG-CE2 4.48Å; R84-F86 HydrophobicContact CG-CZ 4.09Å; R84-L97 HydrophobicContact CB-CB 3.94Å; R84-L97 HydrophobicContact CB-CD2 3.9Å; R84-L97 PolarHBondContact O-N 3.08Å
85	V	96	Very high	94.8	Very high	42 Å²	42	61.1 Å²	61.1	26%	0.255	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.3	172.4	-177.7	0	0	0	0	108.7	I68 L82 L87 V94 W95 L96	I68-V85 HydrophobicContact CD1-CG1 4.13Å; I68-V85 HydrophobicContact CG1-CG2 4.41Å; I68-V85 HydrophobicContact CG2-CG2 4.17Å; L82-V85 HydrophobicContact CD1-CG2 4.21Å; L82-V85 HydrophobicContact CD2-CG2 3.77Å; L82-V85 HydrophobicContact CG-CG2 4.32Å; V85-L87 HydrophobicContact CG1-CD2 4Å; V85-L87 HydrophobicContact CG1-CG 4.35Å; V85-V94 HydrophobicContact CG1-CG1 4.36Å; V85-W95 CarbonylContact C-O 3.52Å; V85-W95 WeakPolarHBondContact CA-O 3.48Å; V85-L96 HydrophobicContact CG1-CD2 4.17Å; V85-L96 HydrophobicContact CG2-CD2 3.94Å
86	F	96.3	Very high	94.8	Very high	9 Å²	9	52.6 Å²	52.6	4%	0.039	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.9	171.8	-52.2	-85.9	0	0	0	110.4	E15 V17 L20 F21 L52 R84 W95 L97	E15-F86 HydrophobicContact CB-CD1 4.47Å; E15-F86 HydrophobicContact CB-CE1 4.16Å; V17-F86 HydrophobicContact CB-CB 4.21Å; V17-F86 HydrophobicContact CB-CD2 4.07Å; V17-F86 HydrophobicContact CB-CG 4.03Å; V17-F86 HydrophobicContact CG2-CD2 4.19Å; V17-F86 HydrophobicContact CG2-CE2 4.48Å; L20-F86 HydrophobicContact CD1-CE1 3.81Å; L20-F86 HydrophobicContact CD1-CZ 4.11Å; F21-F86 HydrophobicContact CE2-CE2 4.04Å; F21-F86 AromaticContact CE2-CZ 3.79Å; F21-F86 HydrophobicContact CE2-CZ 3.79Å; L52-F86 HydrophobicContact CD2-CE2 4.42Å; R84-F86 HydrophobicContact CB-CE2 4.09Å; R84-F86 HydrophobicContact CB-CZ 4.11Å; R84-F86 HydrophobicContact CG-CE1 4.42Å; R84-F86 HydrophobicContact CG-CE2 4.48Å; R84-F86 HydrophobicContact CG-CZ 4.09Å; F86-W95 HydrophobicContact CB-CB 4.13Å; F86-W95 HydrophobicContact CD2-CB 4.32Å; F86-W95 PolarHBondContact N-O 2.83Å; F86-W95 PolarHBondContact O-N 3.2Å; F86-L97 HydrophobicContact CE2-CB 4.11Å; F86-L97 HydrophobicContact CE2-CD2 4.37Å
87	L	94.7	Very high	94.7	Very high	69 Å²	69	51.6 Å²	51.6	36%	0.361	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	108	177.6	-58.5	179.2	0	0	0	108.6	R14 L60 V85 H89 V94	R14-L87 PolarHBondContact NH1-O 2.92Å; L60-L87 HydrophobicContact CD2-CD2 4.34Å; V85-L87 HydrophobicContact CG1-CD2 4Å; V85-L87 HydrophobicContact CG1-CG 4.35Å; L87-H89 PolarHBondContact O-CD2 3.08Å; L87-H89 PolarHBondContact O-N 3.49Å; L87-V94 HydrophobicContact CD2-CB 4.38Å; L87-V94 HydrophobicContact CD2-CG1 3.99Å; L87-V94 HydrophobicContact CD2-CG2 3.91Å
88	N	92.1	Very high	94.7	Very high	29 Å²	29	49.2 Å²	49.2	16%	0.155	24%	0.239	C	C	.	.			trans	-84.2	107.7	173.3	-171.9	-45.7	0	0	0	108.6	T90 T91 R92 R93	N88-T90 VanDerWaalsContact C-N 3.31Å; N88-T90 PolarHBondContact O-N 2.79Å; N88-T90 WeakPolarHBondContact OD1-CB 3.44Å; N88-T90 PolarHBondContact OD1-N 3.07Å; N88-T91 WeakPolarHBondContact CB-OG1 3.12Å; N88-T91 PolarHBondContact OD1-N 3.4Å; N88-T91 PolarHBondContact OD1-OG1 3.15Å; N88-R92 CarbonylContact O-C 3.57Å; N88-R92 WeakPolarHBondContact O-CA 3.42Å; N88-R92 PolarHBondContact O-N 3.41Å; N88-R93 PolarHBondContact N-O 2.87Å; N88-R93 PolarHBondContact O-N 3.21Å
89	H	87.5	Confident	94.6	Very high	115 Å²	115	50.5 Å²	50.5	53%	0.532	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-25.1	-176.9	-76.5	-95.3	0	0	0	113.5	R14 L87	R14-H89 PolarHBondContact NE-CD2 3.29Å; R14-H89 PolarHBondContact NH1-CD2 2.82Å; R14-H89 PolarHBondContact NH1-NE2 2.94Å; R14-H89 PolarHBondContact NH2-NE2 2.73Å; R14-H89 VanDerWaalsContact NH2-NE2 3.1Å; L87-H89 PolarHBondContact O-CD2 3.08Å; L87-H89 PolarHBondContact O-N 3.49Å
90	T	89	Confident	94.6	Very high	134 Å²	134	51.2 Å²	51.2	82%	0.822	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-52	-178.9	-53.4	0	0	0	0	110.6	N88	N88-T90 VanDerWaalsContact C-N 3.31Å; N88-T90 PolarHBondContact O-N 2.79Å; N88-T90 WeakPolarHBondContact OD1-CB 3.44Å; N88-T90 PolarHBondContact OD1-N 3.07Å
91	T	91.3	Very high	94.7	Very high	70 Å²	70	50.5 Å²	50.5	43%	0.429	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-10.2	-179.4	63.5	0	0	0	0	113	N88 R93	N88-T91 WeakPolarHBondContact CB-OG1 3.12Å; N88-T91 PolarHBondContact OD1-N 3.4Å; N88-T91 PolarHBondContact OD1-OG1 3.15Å; T91-R93 PolarHBondContact O-N 3.21Å; T91-R93 WeakPolarHBondContact OG1-CG 3.12Å; T91-R93 PolarHBondContact OG1-N 3.19Å
92	R	92.8	Very high	94.7	Very high	153 Å²	153	49.2 Å²	49.2	58%	0.577	24%	0.237	S	C	*	.			trans	57.7	22.5	-172.4	-55.7	179.6	65.2	-161.8	-0.7	113.1	G59 N88	G59-R92 PolarHBondContact N-O 3.31Å; N88-R92 CarbonylContact O-C 3.57Å; N88-R92 WeakPolarHBondContact O-CA 3.42Å; N88-R92 PolarHBondContact O-N 3.41Å
93	R	92.8	Very high	94.8	Very high	74 Å²	74	48.6 Å²	48.6	28%	0.279	23%	0.234	S	C	.	.			trans	-83.4	146.8	176.9	-62.7	-64.3	-174.6	162.2	7.5	111	G57 N88 T91	G57-R93 WeakPolarHBondContact O-CD 3.41Å; G57-R93 PolarHBondContact O-NH1 3.2Å; N88-R93 PolarHBondContact N-O 2.87Å; N88-R93 PolarHBondContact O-N 3.21Å; T91-R93 PolarHBondContact O-N 3.21Å; T91-R93 WeakPolarHBondContact OG1-CG 3.12Å; T91-R93 PolarHBondContact OG1-N 3.19Å
94	V	93.8	Very high	94.9	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.036	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.5	179.3	-179.5	0	0	0	0	108.2	I55 L60 I68 V85 L87 L96	I55-V94 HydrophobicContact CB-CB 4.3Å; I55-V94 HydrophobicContact CG1-CB 4.28Å; I55-V94 HydrophobicContact CG1-CG1 4.2Å; I55-V94 PolarHBondContact N-O 3.05Å; L60-V94 HydrophobicContact CD2-CG1 4.32Å; L60-V94 HydrophobicContact CD2-CG2 3.79Å; L60-V94 HydrophobicContact CG-CG2 4.32Å; I68-V94 HydrophobicContact CD1-CG1 3.98Å; V85-V94 HydrophobicContact CG1-CG1 4.36Å; L87-V94 HydrophobicContact CD2-CB 4.38Å; L87-V94 HydrophobicContact CD2-CG1 3.99Å; L87-V94 HydrophobicContact CD2-CG2 3.91Å; V94-L96 HydrophobicContact CG1-CD2 4.35Å
95	W	95.3	Very high	95	Very high	17 Å²	17	39.5 Å²	39.5	6%	0.064	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.2	178.4	-61.1	84.6	0	0	0	110.5	V17 F23 Y37 L52 K53 Q54 V85 F86	V17-W95 HydrophobicContact CG1-CD2 4.1Å; V17-W95 HydrophobicContact CG1-CG 4.02Å; F23-W95 HydrophobicContact CD2-CH2 4.5Å; F23-W95 AromaticContact CE2-CH2 3.75Å; F23-W95 HydrophobicContact CE2-CH2 3.75Å; F23-W95 HydrophobicContact CE2-CZ2 4.45Å; F23-W95 HydrophobicContact CE2-CZ3 4.25Å; F23-W95 HydrophobicContact CZ-CH2 4.14Å; F23-W95 HydrophobicContact CZ-CZ2 4.48Å; Y37-W95 HydrophobicContact CD2-CH2 4.22Å; Y37-W95 AromaticContact CD2-CZ3 3.71Å; Y37-W95 HydrophobicContact CD2-CZ3 3.71Å; Y37-W95 AromaticContact CE2-CH2 3.9Å; Y37-W95 HydrophobicContact CE2-CH2 3.9Å; Y37-W95 AromaticContact CE2-CZ3 3.79Å; Y37-W95 HydrophobicContact CE2-CZ3 3.79Å; L52-W95 HydrophobicContact CB-CE3 4.11Å; L52-W95 HydrophobicContact CB-CZ3 4.26Å; K53-W95 CarbonylContact O-C 3.03Å; K53-W95 WeakPolarHBondContact O-CA 3.46Å; Q54-W95 HydrophobicContact CB-CD2 3.98Å; Q54-W95 HydrophobicContact CB-CE3 3.66Å; Q54-W95 HydrophobicContact CB-CH2 3.8Å; Q54-W95 HydrophobicContact CB-CZ2 4.11Å; Q54-W95 HydrophobicContact CB-CZ3 3.57Å; Q54-W95 HydrophobicContact CG-CD2 4.08Å; Q54-W95 HydrophobicContact CG-CE3 4.25Å; Q54-W95 HydrophobicContact CG-CH2 4.04Å; Q54-W95 HydrophobicContact CG-CZ2 3.86Å; Q54-W95 HydrophobicContact CG-CZ3 4.25Å; V85-W95 CarbonylContact C-O 3.52Å; V85-W95 WeakPolarHBondContact CA-O 3.48Å; F86-W95 HydrophobicContact CB-CB 4.13Å; F86-W95 HydrophobicContact CD2-CB 4.32Å; F86-W95 PolarHBondContact N-O 2.83Å; F86-W95 PolarHBondContact O-N 3.2Å
96	L	95.5	Very high	95.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.4	174.5	-52	-174.8	0	0	0	109	L52 K53 I55 E67 I68 L71 L82 V85 V94 F98	L52-L96 WeakPolarHBondContact CA-O 3.43Å; K53-L96 HydrophobicContact CB-CB 4.35Å; K53-L96 PolarHBondContact N-O 3.34Å; K53-L96 PolarHBondContact O-N 3.13Å; I55-L96 HydrophobicContact CD1-CD1 3.86Å; I55-L96 HydrophobicContact CD1-CG 4.23Å; I55-L96 HydrophobicContact CG1-CD1 4.42Å; I55-L96 HydrophobicContact CG1-CG 4.32Å; E67-L96 HydrophobicContact CG-CD1 4.24Å; I68-L96 HydrophobicContact CD1-CD2 4.02Å; I68-L96 HydrophobicContact CG1-CD2 3.63Å; L71-L96 HydrophobicContact CD1-CD1 4.49Å; L82-L96 HydrophobicContact CD1-CB 3.78Å; L82-L96 HydrophobicContact CD1-CD2 4.06Å; L82-L96 HydrophobicContact CD1-CG 4.36Å; V85-L96 HydrophobicContact CG1-CD2 4.17Å; V85-L96 HydrophobicContact CG2-CD2 3.94Å; V94-L96 HydrophobicContact CG1-CD2 4.35Å; L96-F98 HydrophobicContact CB-CD2 4.37Å; L96-F98 HydrophobicContact CB-CE2 3.43Å; L96-F98 VanDerWaalsContact CB-CE2 3.43Å; L96-F98 HydrophobicContact CB-CZ 3.65Å; L96-F98 HydrophobicContact CD1-CE2 4.32Å; L96-F98 HydrophobicContact CD1-CZ 3.94Å; L96-F98 HydrophobicContact CG-CZ 4.46Å
97	L	97.2	Very high	95.1	Very high	9 Å²	9	46.1 Å²	46.1	5%	0.047	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.6	178.1	-177	72.5	0	0	0	110.2	F21 Y50 L52 Q83 R84 F86	F21-L97 HydrophobicContact CD1-CD1 4.49Å; F21-L97 HydrophobicContact CE1-CD1 3.81Å; F21-L97 HydrophobicContact CE1-CD2 4.39Å; F21-L97 HydrophobicContact CE2-CD1 4.14Å; F21-L97 HydrophobicContact CE2-CD2 4.12Å; F21-L97 HydrophobicContact CZ-CD1 3.63Å; F21-L97 HydrophobicContact CZ-CD2 3.55Å; F21-L97 HydrophobicContact CZ-CG 4.26Å; Y50-L97 HydrophobicContact CD1-CD1 3.85Å; Y50-L97 HydrophobicContact CD1-CD2 4.29Å; Y50-L97 HydrophobicContact CD1-CG 4.08Å; Y50-L97 HydrophobicContact CG-CD1 4.03Å; L52-L97 HydrophobicContact CD2-CB 4.27Å; L52-L97 HydrophobicContact CD2-CD1 3.67Å; L52-L97 HydrophobicContact CG-CD1 4.08Å; Q83-L97 HydrophobicContact CB-CB 4.35Å; Q83-L97 HydrophobicContact CB-CD2 4.02Å; Q83-L97 HydrophobicContact CB-CG 4.09Å; Q83-L97 WeakPolarHBondContact CB-O 3.48Å; Q83-L97 PolarHBondContact N-O 3.34Å; R84-L97 HydrophobicContact CB-CB 3.94Å; R84-L97 HydrophobicContact CB-CD2 3.9Å; R84-L97 PolarHBondContact O-N 3.08Å; F86-L97 HydrophobicContact CE2-CB 4.11Å; F86-L97 HydrophobicContact CE2-CD2 4.37Å
98	F	97.2	Very high	95.3	Very high	10 Å²	10	43 Å²	43	4%	0.044	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	162.3	176.3	-52	-85.8	0	0	0	110.5	Y50 A51 K53 L71 I80 T81 L82 L96	Y50-F98 WeakPolarHBondContact CA-O 3.25Å; A51-F98 HydrophobicContact CB-CB 4.3Å; A51-F98 PolarHBondContact N-O 3.48Å; A51-F98 PolarHBondContact O-N 3.13Å; K53-F98 HydrophobicContact CB-CE2 3.99Å; K53-F98 HydrophobicContact CD-CE2 4.48Å; L71-F98 HydrophobicContact CD1-CE1 3.89Å; L71-F98 HydrophobicContact CD1-CZ 3.94Å; I80-F98 HydrophobicContact CD1-CB 3.99Å; I80-F98 HydrophobicContact CD1-CD1 3.75Å; I80-F98 HydrophobicContact CD1-CD2 4.48Å; I80-F98 HydrophobicContact CD1-CE1 4.33Å; I80-F98 HydrophobicContact CD1-CG 3.83Å; I80-F98 HydrophobicContact CG1-CB 4.26Å; I80-F98 HydrophobicContact CG1-CD1 3.72Å; I80-F98 HydrophobicContact CG1-CE1 4.38Å; I80-F98 HydrophobicContact CG1-CG 4.2Å; I80-F98 HydrophobicContact CG2-CD1 4.49Å; I80-F98 HydrophobicContact CG2-CE1 4.33Å; T81-F98 WeakPolarHBondContact O-CD1 3.38Å; L82-F98 HydrophobicContact CB-CE1 4.03Å; L82-F98 HydrophobicContact CD1-CE1 3.97Å; L82-F98 HydrophobicContact CD1-CZ 4.05Å; L96-F98 HydrophobicContact CB-CD2 4.37Å; L96-F98 HydrophobicContact CB-CE2 3.43Å; L96-F98 VanDerWaalsContact CB-CE2 3.43Å; L96-F98 HydrophobicContact CB-CZ 3.65Å; L96-F98 HydrophobicContact CD1-CE2 4.32Å; L96-F98 HydrophobicContact CD1-CZ 3.94Å; L96-F98 HydrophobicContact CG-CZ 4.46Å
99	D	97	Very high	95.5	Very high	34 Å²	34	41.8 Å²	41.8	18%	0.182	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	141.1	162.9	-60.6	-53.6	0	0	0	109.7	R48 Q83 M161	R48-D99 IonicContact NH1-OD1 3.74Å; Q83-D99 PolarHBondContact NE2-OD2 3.32Å; D99-M161 HydrophobicContact CB-CE 4.1Å
100	F	97.5	Very high	96	Very high	15 Å²	15	40.5 Å²	40.5	7%	0.066	19%	0.19	C	C	.	.			trans	-77.8	126.1	-176.4	-171.8	-103.8	0	0	0	112.4	V28 K38 D49 A51 E102 M161	V28-F100 HydrophobicContact CG1-CE2 4.49Å; V28-F100 HydrophobicContact CG1-CZ 4.46Å; V28-F100 HydrophobicContact CG2-CE2 4.18Å; K38-F100 HydrophobicContact CB-CD2 4.2Å; K38-F100 HydrophobicContact CB-CE2 3.68Å; K38-F100 HydrophobicContact CB-CZ 4.07Å; K38-F100 HydrophobicContact CD-CD1 4.29Å; K38-F100 HydrophobicContact CD-CE1 3.74Å; K38-F100 HydrophobicContact CD-CE2 4.01Å; K38-F100 HydrophobicContact CD-CZ 3.59Å; K38-F100 HydrophobicContact CG-CD1 4.43Å; K38-F100 HydrophobicContact CG-CD2 3.93Å; K38-F100 HydrophobicContact CG-CE1 4.2Å; K38-F100 HydrophobicContact CG-CE2 3.69Å; K38-F100 HydrophobicContact CG-CG 4.31Å; K38-F100 HydrophobicContact CG-CZ 3.84Å; D49-F100 VanDerWaalsContact C-CB 3.44Å; D49-F100 HydrophobicContact CB-CB 3.75Å; D49-F100 HydrophobicContact CB-CD1 4.08Å; D49-F100 HydrophobicContact CB-CG 4.09Å; D49-F100 WeakPolarHBondContact O-CB 3.14Å; D49-F100 PolarHBondContact O-N 2.91Å; D49-F100 VanDerWaalsContact O-N 3.16Å; A51-F100 HydrophobicContact CB-CD2 3.99Å; F100-E102 HydrophobicContact CE1-CB 4.22Å; F100-M161 WeakPolarHBondContact O-CE 3.41Å
101	A	97.9	Very high	96.4	Very high	8 Å²	8	36.7 Å²	36.7	7%	0.066	16%	0.162	C	C	.	.			trans	-100.2	108.7	170.4	0	0	0	0	0	110.7	H103 L159 M161 R358	A101-H103 PolarHBondContact O-N 3.49Å; A101-L159 HydrophobicContact CB-CB 3.62Å; A101-L159 HydrophobicContact CB-CD1 4.04Å; A101-L159 HydrophobicContact CB-CG 4.37Å; A101-M161 HydrophobicContact CB-SD 3.89Å; A101-R358 PolarHBondContact O-NE 2.7Å; A101-R358 VanDerWaalsContact O-NE 3.08Å
102	E	97.8	Very high	96.6	Very high	18 Å²	18	34 Å²	34	8%	0.084	15%	0.145	C	C	.	.			trans	-64.6	-25.7	-177.1	-166.8	67.9	-103.1	0	0	112.6	K38 F100 K357 R358	K38-E102 IonicContact NZ-OE2 2.66Å; K38-E102 PolarHBondContact NZ-OE2 3.31Å; F100-E102 HydrophobicContact CE1-CB 4.22Å; E102-K357 HydrophobicContact CG-CB 4.37Å; E102-K357 HydrophobicContact CG-CG 4.01Å; E102-K357 WeakPolarHBondContact OE1-CA 3.17Å; E102-K357 WeakPolarHBondContact OE1-CB 3.3Å; E102-R358 WeakPolarHBondContact O-CG 3.44Å; E102-R358 PolarHBondContact O-NE 3.21Å; E102-R358 PolarHBondContact OE1-N 2.73Å; E102-R358 VanDerWaalsContact OE1-N 3.1Å
103	H	98	Very high	96.7	Very high	10 Å²	10	31.6 Å²	31.6	5%	0.046	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	163.7	-176.6	-50	-63	0	0	0	112.3	A101 I108 L159 V160 R358	A101-H103 PolarHBondContact O-N 3.49Å; H103-I108 HydrophobicContact CB-CD1 4.1Å; H103-I108 HydrophobicContact CB-CG1 4.44Å; H103-L159 WeakPolarHBondContact O-CA 3.18Å; H103-V160 HydrophobicContact CB-CB 4.22Å; H103-V160 PolarHBondContact N-O 3.42Å; H103-V160 VanDerWaalsContact N-O 3.08Å; H103-V160 PolarHBondContact O-N 3.39Å; H103-R358 PolarHBondContact O-NH2 3.38Å
104	D	97.9	Very high	96.9	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.032	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	164.3	165.8	59.8	63.8	0	0	0	109.2	W106 H107 I108 I158 L159 R358	D104-W106 VanDerWaalsContact C-N 3.25Å; D104-W106 PolarHBondContact O-N 3.33Å; D104-W106 WeakPolarHBondContact OD1-CA 3.33Å; D104-W106 VanDerWaalsContact OD1-CB 3.28Å; D104-W106 WeakPolarHBondContact OD1-CB 3.26Å; D104-W106 PolarHBondContact OD1-N 3.26Å; D104-H107 PolarHBondContact O-N 3Å; D104-H107 IonicContact OD1-CG 3.96Å; D104-H107 PolarHBondContact OD1-N 2.96Å; D104-H107 IonicContact OD1-ND1 2.66Å; D104-H107 PolarHBondContact OD1-ND1 3.22Å; D104-H107 IonicContact OD2-CE1 3.22Å; D104-H107 PolarHBondContact OD2-CE1 2.66Å; D104-H107 IonicContact OD2-CG 3.85Å; D104-H107 IonicContact OD2-ND1 2.95Å; D104-H107 PolarHBondContact OD2-ND1 2.95Å; D104-I108 WeakPolarHBondContact O-CG1 3.42Å; D104-I108 PolarHBondContact O-N 3.15Å; D104-I108 VanDerWaalsContact O-N 3.08Å; D104-I158 CarbonylContact C-O 2.93Å; D104-I158 VanDerWaalsContact CA-O 3.28Å; D104-I158 WeakPolarHBondContact CA-O 3.3Å; D104-I158 WeakPolarHBondContact CB-O 3.24Å; D104-L159 HydrophobicContact CB-CD2 3.94Å; D104-R358 IonicContact OD2-CZ 2.85Å; D104-R358 IonicContact OD2-NH1 2.77Å; D104-R358 PolarHBondContact OD2-NH1 2.97Å; D104-R358 IonicContact OD2-NH2 3.83Å; D104-R358 PolarHBondContact OD2-NH2 3.08Å
105	L	98.4	Very high	96.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.2	-29.4	-177.7	-68.9	-168.6	0	0	0	113	I108 I109 L132 I136 P155 I158 V160 I224 L228	L105-I108 HydrophobicContact CD2-CD1 4.23Å; L105-I108 PolarHBondContact O-N 3.24Å; L105-I109 HydrophobicContact CB-CD1 4.21Å; L105-I109 VanDerWaalsContact O-CB 3.24Å; L105-I109 WeakPolarHBondContact O-CB 3.05Å; L105-I109 WeakPolarHBondContact O-CD1 3.37Å; L105-I109 VanDerWaalsContact O-CG1 3.23Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.4Å; L105-L132 HydrophobicContact CD2-CD1 3.83Å; L105-L132 HydrophobicContact CD2-CD2 3.81Å; L105-L132 HydrophobicContact CD2-CG 4.42Å; L105-I136 HydrophobicContact CD1-CD1 3.95Å; L105-P155 HydrophobicContact CB-CB 3.79Å; L105-P155 WeakPolarHBondContact CB-O 3.29Å; L105-P155 PolarHBondContact N-O 3.32Å; L105-I158 HydrophobicContact CB-CB 4.32Å; L105-I158 HydrophobicContact CD1-CB 3.74Å; L105-I158 HydrophobicContact CD1-CG1 4.19Å; L105-I158 HydrophobicContact CD1-CG2 3.57Å; L105-I158 HydrophobicContact CG-CB 3.8Å; L105-I158 HydrophobicContact CG-CG2 3.72Å; L105-I158 PolarHBondContact N-O 3.24Å; L105-V160 HydrophobicContact CD2-CG2 4.22Å; L105-I224 HydrophobicContact CD1-CG2 3.77Å; L105-L228 HydrophobicContact CD1-CD1 4.16Å; L105-L228 HydrophobicContact CD1-CD2 4.24Å; L105-L228 HydrophobicContact CD1-CG 4.47Å; L105-L228 HydrophobicContact CD2-CD2 4.07Å
106	W	96.5	Very high	96.7	Very high	106 Å²	106	36.5 Å²	36.5	40%	0.402	17%	0.166	S	C	.	.	H	α-helix	trans	-62.3	-46.6	178	-176.5	92	0	0	0	111.1	D104 K110 P155 A156	D104-W106 VanDerWaalsContact C-N 3.25Å; D104-W106 PolarHBondContact O-N 3.33Å; D104-W106 WeakPolarHBondContact OD1-CA 3.33Å; D104-W106 VanDerWaalsContact OD1-CB 3.28Å; D104-W106 WeakPolarHBondContact OD1-CB 3.26Å; D104-W106 PolarHBondContact OD1-N 3.26Å; W106-K110 HydrophobicContact CE3-CD 4.42Å; W106-K110 HydrophobicContact CH2-CD 3.7Å; W106-K110 HydrophobicContact CZ2-CD 4.23Å; W106-K110 HydrophobicContact CZ3-CD 3.78Å; W106-K110 WeakPolarHBondContact O-CB 3.37Å; W106-K110 PolarHBondContact O-N 3.11Å; W106-P155 HydrophobicContact CB-CB 4.02Å; W106-P155 PolarHBondContact N-O 3.35Å; W106-A156 HydrophobicContact CB-CB 4.17Å
107	H	97.4	Very high	96.6	Very high	85 Å²	85	40.1 Å²	40.1	39%	0.394	20%	0.196	S	C	.	.	H	α-helix	trans	-68.1	-40.8	176.9	-71.3	90.9	0	0	0	112.3	D104 K110 F111	D104-H107 PolarHBondContact O-N 3Å; D104-H107 IonicContact OD1-CG 3.96Å; D104-H107 PolarHBondContact OD1-N 2.96Å; D104-H107 IonicContact OD1-ND1 2.66Å; D104-H107 PolarHBondContact OD1-ND1 3.22Å; D104-H107 IonicContact OD2-CE1 3.22Å; D104-H107 PolarHBondContact OD2-CE1 2.66Å; D104-H107 IonicContact OD2-CG 3.85Å; D104-H107 IonicContact OD2-ND1 2.95Å; D104-H107 PolarHBondContact OD2-ND1 2.95Å; H107-K110 PolarHBondContact O-N 3.11Å; H107-F111 WeakPolarHBondContact O-CB 3.32Å; H107-F111 PolarHBondContact O-N 3.4Å
108	I	98.1	Very high	96.4	Very high	3 Å²	3	45 Å²	45	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-49.4	177.2	-70.4	168.1	0	0	0	110.7	H103 D104 L105 K110 F111 H112 M128 V160 Y355	H103-I108 HydrophobicContact CB-CD1 4.1Å; H103-I108 HydrophobicContact CB-CG1 4.44Å; D104-I108 WeakPolarHBondContact O-CG1 3.42Å; D104-I108 PolarHBondContact O-N 3.15Å; D104-I108 VanDerWaalsContact O-N 3.08Å; L105-I108 HydrophobicContact CD2-CD1 4.23Å; L105-I108 PolarHBondContact O-N 3.24Å; I108-K110 PolarHBondContact O-N 3.4Å; I108-F111 WeakPolarHBondContact O-CB 3.34Å; I108-F111 PolarHBondContact O-N 3.49Å; I108-H112 PolarHBondContact O-CD2 3.5Å; I108-H112 VanDerWaalsContact O-CD2 3.26Å; I108-H112 PolarHBondContact O-N 3.28Å; I108-H112 VanDerWaalsContact O-N 3.12Å; I108-M128 HydrophobicContact CD1-CE 4.19Å; I108-M128 HydrophobicContact CG2-CE 3.85Å; I108-V160 HydrophobicContact CD1-CB 4.41Å; I108-V160 HydrophobicContact CD1-CG2 4.1Å; I108-Y355 HydrophobicContact CB-CE1 4.43Å; I108-Y355 HydrophobicContact CD1-CD2 4.38Å; I108-Y355 HydrophobicContact CD1-CE2 4.35Å; I108-Y355 HydrophobicContact CG1-CD1 4.2Å; I108-Y355 HydrophobicContact CG1-CD2 3.99Å; I108-Y355 HydrophobicContact CG1-CE1 4.3Å; I108-Y355 HydrophobicContact CG1-CE2 4.14Å; I108-Y355 HydrophobicContact CG1-CG 4.05Å; I108-Y355 HydrophobicContact CG2-CE1 3.92Å; I108-Y355 HydrophobicContact CG2-CE2 4.44Å
109	I	97.6	Very high	96.2	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-45.1	177.8	-72.9	159.1	0	0	0	110.5	L105 F111 H112 R113 P155 E227 L228	L105-I109 HydrophobicContact CB-CD1 4.21Å; L105-I109 VanDerWaalsContact O-CB 3.24Å; L105-I109 WeakPolarHBondContact O-CB 3.05Å; L105-I109 WeakPolarHBondContact O-CD1 3.37Å; L105-I109 VanDerWaalsContact O-CG1 3.23Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.4Å; I109-F111 VanDerWaalsContact C-N 3.31Å; I109-F111 PolarHBondContact O-N 2.96Å; I109-H112 PolarHBondContact O-N 3.26Å; I109-R113 WeakPolarHBondContact O-CB 3.44Å; I109-R113 PolarHBondContact O-N 3.01Å; I109-P155 HydrophobicContact CD1-CB 4.04Å; I109-P155 HydrophobicContact CD1-CG 4.04Å; I109-E227 HydrophobicContact CD1-CB 4.41Å; I109-E227 HydrophobicContact CD1-CG 3.81Å; I109-E227 HydrophobicContact CG1-CG 4.49Å; I109-E227 HydrophobicContact CG2-CG 3.97Å; I109-L228 HydrophobicContact CD1-CD2 4.06Å; I109-L228 HydrophobicContact CD1-CG 4.44Å; I109-L228 HydrophobicContact CG1-CD2 4.02Å
110	K	96.7	Very high	95.9	Very high	88 Å²	88	55.5 Å²	55.5	38%	0.383	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-40.6	177.7	-177.8	-179.8	176.4	-173.8	0	112.1	W106 H107 I108 R113 T114	W106-K110 HydrophobicContact CE3-CD 4.42Å; W106-K110 HydrophobicContact CH2-CD 3.7Å; W106-K110 HydrophobicContact CZ2-CD 4.23Å; W106-K110 HydrophobicContact CZ3-CD 3.78Å; W106-K110 WeakPolarHBondContact O-CB 3.37Å; W106-K110 PolarHBondContact O-N 3.11Å; H107-K110 PolarHBondContact O-N 3.11Å; I108-K110 PolarHBondContact O-N 3.4Å; K110-R113 PolarHBondContact O-N 3.34Å; K110-T114 WeakPolarHBondContact O-CB 3.42Å; K110-T114 PolarHBondContact O-N 3.15Å; K110-T114 PolarHBondContact O-OG1 2.86Å
111	F	97.2	Very high	95.4	Very high	55 Å²	55	61.6 Å²	61.6	24%	0.241	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-48.5	176.4	176.8	-88.9	0	0	0	111.4	H107 I108 I109 T114 T115 V122 Y355	H107-F111 WeakPolarHBondContact O-CB 3.32Å; H107-F111 PolarHBondContact O-N 3.4Å; I108-F111 WeakPolarHBondContact O-CB 3.34Å; I108-F111 PolarHBondContact O-N 3.49Å; I109-F111 VanDerWaalsContact C-N 3.31Å; I109-F111 PolarHBondContact O-N 2.96Å; F111-T114 PolarHBondContact O-N 3.42Å; F111-T115 WeakPolarHBondContact O-CB 3.32Å; F111-T115 PolarHBondContact O-N 2.89Å; F111-T115 PolarHBondContact O-OG1 3.49Å; F111-V122 HydrophobicContact CE1-CB 4.17Å; F111-V122 HydrophobicContact CE1-CG1 4.05Å; F111-V122 HydrophobicContact CE1-CG2 3.96Å; F111-V122 HydrophobicContact CZ-CG2 4.35Å; F111-Y355 HydrophobicContact CB-CD1 4.25Å; F111-Y355 AromaticContact CD1-CD1 3.76Å; F111-Y355 HydrophobicContact CD1-CD1 3.76Å; F111-Y355 AromaticContact CD1-CE1 3.81Å; F111-Y355 HydrophobicContact CD1-CE1 3.81Å; F111-Y355 HydrophobicContact CE1-CD1 4.27Å; F111-Y355 HydrophobicContact CE1-CE1 4.31Å; F111-Y355 AromaticContact CG-CD1 3.97Å; F111-Y355 HydrophobicContact CG-CD1 3.97Å; F111-Y355 HydrophobicContact CG-CE1 4.42Å
112	H	96.6	Very high	95.1	Very high	12 Å²	12	63.1 Å²	63.1	6%	0.056	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-41.6	177.7	-81.2	-69.3	0	0	0	112.9	I108 I109 T114 T115 K116 Y231 Y355	I108-H112 PolarHBondContact O-CD2 3.5Å; I108-H112 VanDerWaalsContact O-CD2 3.26Å; I108-H112 PolarHBondContact O-N 3.28Å; I108-H112 VanDerWaalsContact O-N 3.12Å; I109-H112 PolarHBondContact O-N 3.26Å; H112-T114 VanDerWaalsContact C-N 3.33Å; H112-T114 PolarHBondContact O-N 3.32Å; H112-T115 PolarHBondContact O-N 2.65Å; H112-K116 WeakPolarHBondContact O-CB 3.4Å; H112-K116 PolarHBondContact O-N 3.05Å; H112-Y231 HydrophobicContact CB-CD1 3.49Å; H112-Y231 VanDerWaalsContact CB-CD1 3.49Å; H112-Y231 HydrophobicContact CB-CD2 3.78Å; H112-Y231 HydrophobicContact CB-CE1 3.44Å; H112-Y231 VanDerWaalsContact CB-CE1 3.44Å; H112-Y231 HydrophobicContact CB-CE2 3.73Å; H112-Y231 HydrophobicContact CB-CG 3.66Å; H112-Y231 AromaticContact CG-CE1 3.63Å; H112-Y231 AromaticContact CG-CZ 3.62Å; H112-Y231 AromaticContact ND1-CZ 3.8Å; H112-Y355 AromaticContact CD2-CE1 4Å; H112-Y355 AromaticContact NE2-CE1 3.59Å; H112-Y355 AromaticContact NE2-CZ 3.79Å; H112-Y355 PolarHBondContact NE2-OH 2.87Å
113	R	95.1	Very high	94.7	Very high	104 Å²	104	69.9 Å²	69.9	39%	0.392	35%	0.354	S	S	.	.	H	α-helix	trans	-58	-44.8	174.3	-174.2	174.7	64.2	-165.8	1	111.8	I109 K110 A117 Y231	I109-R113 WeakPolarHBondContact O-CB 3.44Å; I109-R113 PolarHBondContact O-N 3.01Å; K110-R113 PolarHBondContact O-N 3.34Å; R113-A117 WeakPolarHBondContact O-CB 3.49Å; R113-A117 PolarHBondContact O-N 3.35Å; R113-Y231 WeakPolarHBondContact CD-O 3.43Å
114	T	95.4	Very high	94.5	Very high	64 Å²	64	71.7 Å²	71.7	39%	0.393	37%	0.366	S	S	.	.	H	α-helix	trans	-67.6	-43.3	178.7	-52.9	0	0	0	0	111.3	K110 F111 H112 K116 A117 N118	K110-T114 WeakPolarHBondContact O-CB 3.42Å; K110-T114 PolarHBondContact O-N 3.15Å; K110-T114 PolarHBondContact O-OG1 2.86Å; F111-T114 PolarHBondContact O-N 3.42Å; H112-T114 VanDerWaalsContact C-N 3.33Å; H112-T114 PolarHBondContact O-N 3.32Å; T114-K116 PolarHBondContact O-N 3.37Å; T114-A117 PolarHBondContact O-N 2.87Å; T114-N118 WeakPolarHBondContact O-CB 2.82Å; T114-N118 PolarHBondContact O-N 2.65Å
115	T	94.7	Very high	94.3	Very high	22 Å²	22	73 Å²	73	14%	0.135	37%	0.37	C	S	.	.	H	α-helix	trans	-59.9	-44.8	177.1	-61.6	0	0	0	0	111.5	F111 H112 N118 K119 S120 V122	F111-T115 WeakPolarHBondContact O-CB 3.32Å; F111-T115 PolarHBondContact O-N 2.89Å; F111-T115 PolarHBondContact O-OG1 3.49Å; H112-T115 PolarHBondContact O-N 2.65Å; T115-N118 CarbonylContact O-C 3.52Å; T115-N118 PolarHBondContact O-N 2.71Å; T115-K119 PolarHBondContact O-N 3.2Å; T115-S120 VanDerWaalsContact CG2-O 3.22Å; T115-S120 WeakPolarHBondContact CG2-O 3.2Å; T115-S120 PolarHBondContact O-N 3.19Å; T115-V122 HydrophobicContact CG2-CB 4.29Å; T115-V122 HydrophobicContact CG2-CG1 4.08Å
116	K	91.5	Very high	94.1	Very high	114 Å²	114	76.8 Å²	76.8	50%	0.496	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-44.5	174.7	-175.7	179.6	178.2	-175.5	0	112.1	H112 T114 N118 K119 Y231	H112-K116 WeakPolarHBondContact O-CB 3.4Å; H112-K116 PolarHBondContact O-N 3.05Å; T114-K116 PolarHBondContact O-N 3.37Å; K116-N118 VanDerWaalsContact C-N 3.3Å; K116-N118 PolarHBondContact O-N 3.29Å; K116-K119 PolarHBondContact O-N 3.47Å; K116-K119 VanDerWaalsContact O-N 3.14Å; K116-Y231 HydrophobicContact CD-CD2 4.39Å
117	A	92.9	Very high	94.1	Very high	77 Å²	77	72.3 Å²	72.3	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-62.6	-37.6	177	0	0	0	0	0	112.2	R113 T114 K119	R113-A117 WeakPolarHBondContact O-CB 3.49Å; R113-A117 PolarHBondContact O-N 3.35Å; T114-A117 PolarHBondContact O-N 2.87Å; A117-K119 PolarHBondContact O-N 3.14Å
118	N	94.2	Very high	94.1	Very high	110 Å²	110	68.9 Å²	68.9	59%	0.588	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	5.8	177.3	-67.2	-14.8	0	0	0	113.7	T114 T115 K116 S120	T114-N118 WeakPolarHBondContact O-CB 2.82Å; T114-N118 PolarHBondContact O-N 2.65Å; T115-N118 CarbonylContact O-C 3.52Å; T115-N118 PolarHBondContact O-N 2.71Å; K116-N118 VanDerWaalsContact C-N 3.3Å; K116-N118 PolarHBondContact O-N 3.29Å; N118-S120 PolarHBondContact O-N 3.31Å; N118-S120 PolarHBondContact O-OG 3.38Å
119	K	91.6	Very high	94.1	Very high	196 Å²	196	70.2 Å²	70.2	85%	0.852	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	27.4	-176.5	-56.3	178.9	-177.8	176.1	0	113.4	T115 K116 A117	T115-K119 PolarHBondContact O-N 3.2Å; K116-K119 PolarHBondContact O-N 3.47Å; K116-K119 VanDerWaalsContact O-N 3.14Å; A117-K119 PolarHBondContact O-N 3.14Å
120	S	91.1	Very high	94.1	Very high	69 Å²	69	70.8 Å²	70.8	48%	0.483	39%	0.389	S	S	.	.			trans	-92.3	155.1	176.2	-62.6	0	0	0	0	109.1	T115 N118	T115-S120 VanDerWaalsContact CG2-O 3.22Å; T115-S120 WeakPolarHBondContact CG2-O 3.2Å; T115-S120 PolarHBondContact O-N 3.19Å; N118-S120 PolarHBondContact O-N 3.31Å; N118-S120 PolarHBondContact O-OG 3.38Å
121	T	87.6	Confident	94.2	Very high	143 Å²	143	66.6 Å²	66.6	88%	0.877	37%	0.37	S	S	*	.			trans	-109.8	142.6	173.9	55.9	0	0	0	0	109.3
122	V	90.4	Very high	94.3	Very high	41 Å²	41	64 Å²	64	25%	0.248	36%	0.359	C	S	.	.			trans	-124.6	131.2	170.8	60.7	0	0	0	0	107.6	F111 T115 V124 P354	F111-V122 HydrophobicContact CE1-CB 4.17Å; F111-V122 HydrophobicContact CE1-CG1 4.05Å; F111-V122 HydrophobicContact CE1-CG2 3.96Å; F111-V122 HydrophobicContact CZ-CG2 4.35Å; T115-V122 HydrophobicContact CG2-CB 4.29Å; T115-V122 HydrophobicContact CG2-CG1 4.08Å; V122-V124 HydrophobicContact CG1-CG1 4.23Å; V122-V124 HydrophobicContact CG2-CG1 4.36Å; V122-V124 PolarHBondContact O-N 3.33Å; V122-P354 HydrophobicContact CG2-CB 3.65Å; V122-P354 HydrophobicContact CG2-CG 3.88Å
123	Q	90.1	Very high	94.4	Very high	160 Å²	160	63.5 Å²	63.5	75%	0.748	36%	0.356	S	S	*	.			trans	-75.1	122	173	-174	175.8	-9.2	0	0	108.7
124	V	92.6	Very high	94.5	Very high	48 Å²	48	62.2 Å²	62.2	29%	0.291	35%	0.352	S	S	.	.			trans	-129.1	158.8	172.9	-68.1	0	0	0	0	109.9	V122 G126 P354	V122-V124 HydrophobicContact CG1-CG1 4.23Å; V122-V124 HydrophobicContact CG2-CG1 4.36Å; V122-V124 PolarHBondContact O-N 3.33Å; V124-G126 PolarHBondContact O-N 3.09Å; V124-P354 HydrophobicContact CG1-CG 4.32Å
125	Y	95.3	Very high	94.7	Very high	32 Å²	32	59.6 Å²	59.6	13%	0.125	34%	0.336	C	S	.	.			trans	-63.4	123.8	175	177.3	-130.9	0	0	0	110	N127 M128 E341 N344 F348	Y125-N127 HydrophobicContact CD1-CB 4.23Å; Y125-N127 HydrophobicContact CE1-CB 3.6Å; Y125-N127 HydrophobicContact CE2-CB 4.23Å; Y125-N127 PolarHBondContact O-N 2.7Å; Y125-N127 VanDerWaalsContact O-N 3.13Å; Y125-M128 HydrophobicContact CD1-CB 4.49Å; Y125-M128 WeakPolarHBondContact O-CB 3.31Å; Y125-M128 PolarHBondContact O-N 3.4Å; Y125-E341 PolarHBondContact OH-OE1 2.78Å; Y125-N344 HydrophobicContact CE1-CB 3.88Å; Y125-F348 WeakPolarHBondContact CB-O 3.23Å
126	G	94.4	Very high	94.9	Very high	81 Å²	81	58.6 Å²	58.6	84%	0.835	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.1	-173.3	0	0	0	0	0	114.1	V124	V124-G126 PolarHBondContact O-N 3.09Å
127	N	95.3	Very high	95.2	Very high	12 Å²	12	53.1 Å²	53.1	6%	0.064	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	13.9	179.2	-148.5	26.7	0	0	0	113.5	Y125 V129 K130 S131 E341 K342	Y125-N127 HydrophobicContact CD1-CB 4.23Å; Y125-N127 HydrophobicContact CE1-CB 3.6Å; Y125-N127 HydrophobicContact CE2-CB 4.23Å; Y125-N127 PolarHBondContact O-N 2.7Å; Y125-N127 VanDerWaalsContact O-N 3.13Å; N127-V129 PolarHBondContact O-N 3.44Å; N127-K130 PolarHBondContact O-N 3.5Å; N127-K130 WeakPolarHBondContact OD1-CB 3.18Å; N127-K130 VanDerWaalsContact OD1-CD 3.27Å; N127-K130 WeakPolarHBondContact OD1-CD 3.35Å; N127-K130 VanDerWaalsContact OD1-CE 3.31Å; N127-K130 WeakPolarHBondContact OD1-CE 3.48Å; N127-S131 WeakPolarHBondContact O-CB 3.38Å; N127-S131 PolarHBondContact O-N 2.96Å; N127-S131 PolarHBondContact O-OG 3.08Å; N127-E341 PolarHBondContact ND2-O 2.86Å; N127-K342 PolarHBondContact ND2-O 3.28Å
128	M	97.7	Very high	95.5	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.059	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-48.3	-176.6	176.7	171.2	176	0	0	112.2	I108 Y125 K130 S131 L132 V347 F348 Y355	I108-M128 HydrophobicContact CD1-CE 4.19Å; I108-M128 HydrophobicContact CG2-CE 3.85Å; Y125-M128 HydrophobicContact CD1-CB 4.49Å; Y125-M128 WeakPolarHBondContact O-CB 3.31Å; Y125-M128 PolarHBondContact O-N 3.4Å; M128-K130 PolarHBondContact O-N 3.35Å; M128-S131 PolarHBondContact O-N 3.28Å; M128-L132 HydrophobicContact CE-CD1 3.88Å; M128-L132 HydrophobicContact CG-CD1 3.93Å; M128-L132 HydrophobicContact CG-CG 4.4Å; M128-L132 WeakPolarHBondContact O-CB 3.32Å; M128-L132 WeakPolarHBondContact O-CG 3.39Å; M128-L132 PolarHBondContact O-N 3.43Å; M128-V347 WeakPolarHBondContact CA-O 3.45Å; M128-V347 WeakPolarHBondContact CB-O 3.33Å; M128-V347 HydrophobicContact CG-CB 4.5Å; M128-V347 VanDerWaalsContact CG-O 3.28Å; M128-V347 WeakPolarHBondContact CG-O 3.41Å; M128-F348 HydrophobicContact CE-CD1 4.1Å; M128-F348 HydrophobicContact CE-CE1 3.83Å; M128-F348 HydrophobicContact SD-CD1 4.28Å; M128-Y355 HydrophobicContact CE-CE2 3.91Å; M128-Y355 VanDerWaalsContact CE-OH 3.26Å; M128-Y355 WeakPolarHBondContact CE-OH 3.42Å; M128-Y355 HydrophobicContact SD-CE2 4.48Å; M128-Y355 PolarHBondContact SD-OH 2.95Å
129	V	97.8	Very high	95.7	Very high	31 Å²	31	46.1 Å²	46.1	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-61.9	-46.6	-179.3	176.8	0	0	0	0	111	N127 S131 L132 M133 F225 L228 L229	N127-V129 PolarHBondContact O-N 3.44Å; V129-S131 VanDerWaalsContact C-N 3.3Å; V129-S131 PolarHBondContact O-N 3.06Å; V129-L132 PolarHBondContact O-N 2.81Å; V129-M133 HydrophobicContact CG1-CG 4.33Å; V129-M133 WeakPolarHBondContact O-CB 3.2Å; V129-M133 VanDerWaalsContact O-CG 3.3Å; V129-M133 WeakPolarHBondContact O-CG 3.3Å; V129-M133 PolarHBondContact O-N 3.4Å; V129-F225 HydrophobicContact CG1-CD2 4.03Å; V129-F225 HydrophobicContact CG1-CE2 3.74Å; V129-L228 HydrophobicContact CG1-CB 4.01Å; V129-L228 HydrophobicContact CG1-CD1 4.47Å; V129-L228 HydrophobicContact CG2-CB 4.39Å; V129-L229 HydrophobicContact CG1-CD2 4.15Å
130	K	98.1	Very high	96.1	Very high	16 Å²	16	36.8 Å²	36.8	7%	0.07	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-44.3	176.5	-170.7	-176.9	-63.2	-164	0	111.5	N127 M128 M133 Y134 Y336 F337 E339 E341 P343	N127-K130 PolarHBondContact O-N 3.5Å; N127-K130 WeakPolarHBondContact OD1-CB 3.18Å; N127-K130 VanDerWaalsContact OD1-CD 3.27Å; N127-K130 WeakPolarHBondContact OD1-CD 3.35Å; N127-K130 VanDerWaalsContact OD1-CE 3.31Å; N127-K130 WeakPolarHBondContact OD1-CE 3.48Å; M128-K130 PolarHBondContact O-N 3.35Å; K130-M133 PolarHBondContact O-N 3.02Å; K130-Y134 WeakPolarHBondContact O-CB 3.32Å; K130-Y134 PolarHBondContact O-N 2.66Å; K130-Y336 WeakPolarHBondContact CA-OH 3.4Å; K130-Y336 HydrophobicContact CB-CE1 3.96Å; K130-Y336 WeakPolarHBondContact CB-OH 3.42Å; K130-Y336 WeakPolarHBondContact CD-O 3.39Å; K130-Y336 WeakPolarHBondContact CE-O 3.22Å; K130-Y336 HydrophobicContact CG-CD1 4.19Å; K130-Y336 HydrophobicContact CG-CE1 3.65Å; K130-Y336 HydrophobicContact CG-CE2 4.47Å; K130-Y336 PolarHBondContact N-OH 2.99Å; K130-Y336 PolarHBondContact NZ-O 3.1Å; K130-F337 HydrophobicContact CD-CD1 4.3Å; K130-F337 HydrophobicContact CG-CD1 3.68Å; K130-F337 HydrophobicContact CG-CE1 3.87Å; K130-F337 WeakPolarHBondContact O-CE1 3.41Å; K130-E339 PolarHBondContact NZ-O 2.96Å; K130-E339 VanDerWaalsContact NZ-O 3.13Å; K130-E341 WeakPolarHBondContact CD-O 3.32Å; K130-E341 PolarHBondContact NZ-O 3.24Å; K130-E341 VanDerWaalsContact NZ-O 3.13Å; K130-P343 HydrophobicContact CD-CG 4.3Å; K130-P343 HydrophobicContact CG-CG 4.21Å
131	S	98.4	Very high	96.4	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-43.2	-179.4	-54.5	0	0	0	0	112.2	N127 M128 V129 Q135 N344	N127-S131 WeakPolarHBondContact O-CB 3.38Å; N127-S131 PolarHBondContact O-N 2.96Å; N127-S131 PolarHBondContact O-OG 3.08Å; M128-S131 PolarHBondContact O-N 3.28Å; V129-S131 VanDerWaalsContact C-N 3.3Å; V129-S131 PolarHBondContact O-N 3.06Å; S131-Q135 WeakPolarHBondContact O-CB 2.99Å; S131-Q135 WeakPolarHBondContact O-CG 3.17Å; S131-Q135 PolarHBondContact O-N 2.59Å; S131-Q135 VanDerWaalsContact O-N 3.12Å; S131-N344 PolarHBondContact OG-N 3.06Å
132	L	98.8	Very high	96.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-51.6	172.3	-74.8	168.2	0	0	0	111.2	L105 M128 V129 Y134 Q135 I136 V160 V170 L228 V347	L105-L132 HydrophobicContact CD2-CD1 3.83Å; L105-L132 HydrophobicContact CD2-CD2 3.81Å; L105-L132 HydrophobicContact CD2-CG 4.42Å; M128-L132 HydrophobicContact CE-CD1 3.88Å; M128-L132 HydrophobicContact CG-CD1 3.93Å; M128-L132 HydrophobicContact CG-CG 4.4Å; M128-L132 WeakPolarHBondContact O-CB 3.32Å; M128-L132 WeakPolarHBondContact O-CG 3.39Å; M128-L132 PolarHBondContact O-N 3.43Å; V129-L132 PolarHBondContact O-N 2.81Å; L132-Y134 PolarHBondContact O-N 3.33Å; L132-Q135 PolarHBondContact O-N 3.27Å; L132-I136 WeakPolarHBondContact O-CD1 3.15Å; L132-I136 WeakPolarHBondContact O-CG1 3.4Å; L132-I136 PolarHBondContact O-N 3.01Å; L132-V160 HydrophobicContact CD2-CG2 3.95Å; L132-V170 HydrophobicContact CD2-CG2 3.64Å; L132-L228 HydrophobicContact CB-CD1 4.31Å; L132-L228 HydrophobicContact CD1-CD1 4.29Å; L132-L228 HydrophobicContact CD1-CD2 3.97Å; L132-V347 HydrophobicContact CD2-CB 4.12Å; L132-V347 HydrophobicContact CD2-CG1 3.95Å; L132-V347 HydrophobicContact CD2-CG2 3.89Å; L132-V347 HydrophobicContact CG-CB 4.11Å; L132-V347 HydrophobicContact CG-CG1 4.09Å; L132-V347 HydrophobicContact CG-CG2 4.31Å
133	M	98.7	Very high	97.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-44.3	-177.7	-73.3	-53.7	-54.6	0	0	112.6	V129 K130 Q135 I136 L137 I221 F225 L228 L317 F337	V129-M133 HydrophobicContact CG1-CG 4.33Å; V129-M133 WeakPolarHBondContact O-CB 3.2Å; V129-M133 VanDerWaalsContact O-CG 3.3Å; V129-M133 WeakPolarHBondContact O-CG 3.3Å; V129-M133 PolarHBondContact O-N 3.4Å; K130-M133 PolarHBondContact O-N 3.02Å; M133-Q135 PolarHBondContact O-N 3.07Å; M133-I136 PolarHBondContact O-N 3.43Å; M133-I136 HydrophobicContact SD-CD1 4.36Å; M133-L137 WeakPolarHBondContact O-CB 3.45Å; M133-L137 WeakPolarHBondContact O-CG 3.46Å; M133-L137 PolarHBondContact O-N 3.42Å; M133-I221 HydrophobicContact CE-CG2 3.48Å; M133-I221 VanDerWaalsContact CE-CG2 3.48Å; M133-F225 HydrophobicContact CE-CB 3.55Å; M133-F225 HydrophobicContact CE-CD1 4.29Å; M133-F225 HydrophobicContact CE-CD2 4.23Å; M133-F225 HydrophobicContact CE-CG 3.78Å; M133-F225 HydrophobicContact CG-CB 4.47Å; M133-F225 HydrophobicContact CG-CD2 3.47Å; M133-F225 VanDerWaalsContact CG-CD2 3.47Å; M133-F225 HydrophobicContact CG-CE2 3.84Å; M133-F225 HydrophobicContact CG-CG 4.01Å; M133-F225 HydrophobicContact SD-CB 3.58Å; M133-F225 VanDerWaalsContact SD-CB 3.58Å; M133-F225 HydrophobicContact SD-CD2 3.69Å; M133-F225 HydrophobicContact SD-CG 3.78Å; M133-L228 HydrophobicContact CG-CD1 4.41Å; M133-L228 HydrophobicContact SD-CD1 3.9Å; M133-L317 HydrophobicContact CE-CD1 4.38Å; M133-F337 HydrophobicContact CB-CE1 4.11Å; M133-F337 HydrophobicContact CB-CZ 3.93Å
134	Y	98.8	Very high	97.5	Very high	78 Å²	78	21.9 Å²	21.9	31%	0.306	13%	0.125	S	C	.	.	H	α-helix	trans	-61.1	-45.4	177.4	-170.1	-95.8	0	0	0	111.4	K130 L132 L137 N138 M332 F337 P343	K130-Y134 WeakPolarHBondContact O-CB 3.32Å; K130-Y134 PolarHBondContact O-N 2.66Å; L132-Y134 PolarHBondContact O-N 3.33Å; Y134-L137 PolarHBondContact O-N 3.03Å; Y134-N138 VanDerWaalsContact O-CB 3.28Å; Y134-N138 WeakPolarHBondContact O-CB 3.42Å; Y134-N138 PolarHBondContact O-N 3.47Å; Y134-M332 HydrophobicContact CE1-CE 4.15Å; Y134-M332 HydrophobicContact CE2-CB 4.17Å; Y134-M332 HydrophobicContact CE2-CE 4.01Å; Y134-M332 HydrophobicContact CE2-CG 4.36Å; Y134-F337 HydrophobicContact CD2-CB 4.11Å; Y134-F337 AromaticContact CD2-CD1 3.73Å; Y134-F337 HydrophobicContact CD2-CD1 3.73Å; Y134-F337 HydrophobicContact CD2-CD2 4.13Å; Y134-F337 HydrophobicContact CD2-CE1 4.15Å; Y134-F337 AromaticContact CD2-CG 3.72Å; Y134-F337 HydrophobicContact CD2-CG 3.72Å; Y134-F337 HydrophobicContact CE2-CB 4.42Å; Y134-F337 HydrophobicContact CE2-CG 4.43Å; Y134-F337 HydrophobicContact CG-CD1 4.29Å; Y134-F337 HydrophobicContact CG-CE1 4.45Å; Y134-P343 HydrophobicContact CD1-CB 4.16Å; Y134-P343 HydrophobicContact CD1-CG 4.31Å; Y134-P343 HydrophobicContact CD2-CG 3.94Å; Y134-P343 HydrophobicContact CG-CB 3.95Å; Y134-P343 HydrophobicContact CG-CG 3.73Å
135	Q	98.8	Very high	97.6	Very high	9 Å²	9	23.7 Å²	23.7	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-68.6	-34.9	-179.9	-71	-169.9	44.8	0	0	113.2	N78 S131 L132 M133 G139 V170 N344 N345	N78-Q135 VanDerWaalsContact CB-O 3.3Å; N78-Q135 WeakPolarHBondContact CB-O 3.49Å; N78-Q135 PolarHBondContact ND2-OE1 3.22Å; S131-Q135 WeakPolarHBondContact O-CB 2.99Å; S131-Q135 WeakPolarHBondContact O-CG 3.17Å; S131-Q135 PolarHBondContact O-N 2.59Å; S131-Q135 VanDerWaalsContact O-N 3.12Å; L132-Q135 PolarHBondContact O-N 3.27Å; M133-Q135 PolarHBondContact O-N 3.07Å; Q135-G139 PolarHBondContact O-N 3.32Å; Q135-V170 HydrophobicContact CB-CB 3.82Å; Q135-V170 HydrophobicContact CB-CG2 3.77Å; Q135-N344 PolarHBondContact NE2-O 2.68Å; Q135-N344 VanDerWaalsContact NE2-O 3.08Å; Q135-N345 PolarHBondContact NE2-O 3.09Å
136	I	98.8	Very high	97.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-49.8	172.8	-66.5	161.8	0	0	0	110	L105 L132 M133 N138 G139 I140 I158 V170 I221 I224	L105-I136 HydrophobicContact CD1-CD1 3.95Å; L132-I136 WeakPolarHBondContact O-CD1 3.15Å; L132-I136 WeakPolarHBondContact O-CG1 3.4Å; L132-I136 PolarHBondContact O-N 3.01Å; M133-I136 PolarHBondContact O-N 3.43Å; M133-I136 HydrophobicContact SD-CD1 4.36Å; I136-N138 VanDerWaalsContact C-N 3.31Å; I136-N138 PolarHBondContact O-N 2.94Å; I136-G139 PolarHBondContact O-N 3.26Å; I136-I140 WeakPolarHBondContact O-CG1 3.2Å; I136-I140 PolarHBondContact O-N 3.49Å; I136-I158 HydrophobicContact CD1-CG2 3.94Å; I136-I158 HydrophobicContact CG1-CG2 3.8Å; I136-I158 HydrophobicContact CG2-CD1 4.47Å; I136-V170 HydrophobicContact CG1-CG1 4.04Å; I136-I221 HydrophobicContact CG2-CD1 4.23Å; I136-I221 HydrophobicContact CG2-CG1 3.94Å; I136-I221 HydrophobicContact CG2-CG2 4.34Å; I136-I224 HydrophobicContact CD1-CG2 4.29Å
137	L	98.8	Very high	97.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.8	-41.8	178.2	-72.5	168.1	0	0	0	111.5	M133 Y134 G139 I140 H141 I221 A328 A331 M332 F337	M133-L137 WeakPolarHBondContact O-CB 3.45Å; M133-L137 WeakPolarHBondContact O-CG 3.46Å; M133-L137 PolarHBondContact O-N 3.42Å; Y134-L137 PolarHBondContact O-N 3.03Å; L137-G139 PolarHBondContact O-N 2.98Å; L137-I140 PolarHBondContact O-N 2.81Å; L137-H141 VanDerWaalsContact O-CB 3.28Å; L137-H141 WeakPolarHBondContact O-CB 3.18Å; L137-H141 PolarHBondContact O-N 3.31Å; L137-I221 HydrophobicContact CD2-CD1 4.07Å; L137-I221 HydrophobicContact CD2-CG2 3.97Å; L137-I221 HydrophobicContact CG-CG2 4.41Å; L137-A328 HydrophobicContact CD2-CB 4.41Å; L137-A331 HydrophobicContact CD1-CB 3.79Å; L137-A331 HydrophobicContact CD2-CB 3.8Å; L137-A331 HydrophobicContact CG-CB 4.44Å; L137-M332 HydrophobicContact CB-CG 3.62Å; L137-M332 HydrophobicContact CB-SD 4.24Å; L137-M332 HydrophobicContact CD1-CG 4.37Å; L137-F337 HydrophobicContact CD1-CE2 3.59Å; L137-F337 HydrophobicContact CD1-CZ 3.74Å
138	N	98.7	Very high	97.2	Very high	40 Å²	40	27 Å²	27	21%	0.214	13%	0.125	C	C	.	.	H	α-helix	trans	-60.2	-45.1	176.8	-170	39.6	0	0	0	112	H76 N78 Y134 I136 Y142 M332	H76-N138 PolarHBondContact CE1-ND2 3.22Å; H76-N138 VanDerWaalsContact CE1-ND2 3.26Å; H76-N138 PolarHBondContact CE1-O 3.43Å; H76-N138 PolarHBondContact NE2-ND2 2.96Å; N78-N138 PolarHBondContact OD1-ND2 3.15Å; Y134-N138 VanDerWaalsContact O-CB 3.28Å; Y134-N138 WeakPolarHBondContact O-CB 3.42Å; Y134-N138 PolarHBondContact O-N 3.47Å; I136-N138 VanDerWaalsContact C-N 3.31Å; I136-N138 PolarHBondContact O-N 2.94Å; N138-Y142 PolarHBondContact O-N 3.12Å; N138-M332 HydrophobicContact CB-CE 3.85Å; N138-M332 HydrophobicContact CB-SD 4.22Å
139	G	98.6	Very high	96.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.7	-43.2	175.4	0	0	0	0	0	113.4	Q135 I136 L137 Y142 L143	Q135-G139 PolarHBondContact O-N 3.32Å; I136-G139 PolarHBondContact O-N 3.26Å; L137-G139 PolarHBondContact O-N 2.98Å; G139-Y142 PolarHBondContact O-N 3.27Å; G139-L143 WeakPolarHBondContact O-CG 3.21Å; G139-L143 PolarHBondContact O-N 3.26Å; G139-L143 VanDerWaalsContact O-N 3.13Å
140	I	98.4	Very high	96.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-70.4	-38	178.9	-67.9	-55.7	0	0	0	112.4	I136 L137 Y142 L143 H144 H150 L153 I172 D217 I218 I221 A328	I136-I140 WeakPolarHBondContact O-CG1 3.2Å; I136-I140 PolarHBondContact O-N 3.49Å; L137-I140 PolarHBondContact O-N 2.81Å; I140-Y142 VanDerWaalsContact C-N 3.31Å; I140-Y142 PolarHBondContact O-N 3.31Å; I140-L143 HydrophobicContact CD1-CD1 4.03Å; I140-L143 PolarHBondContact O-N 2.93Å; I140-H144 WeakPolarHBondContact CG2-CE1 3.42Å; I140-H144 WeakPolarHBondContact CG2-NE2 3.37Å; I140-H144 VanDerWaalsContact O-CB 3.29Å; I140-H144 WeakPolarHBondContact O-CB 2.66Å; I140-H144 PolarHBondContact O-CD2 3.01Å; I140-H144 VanDerWaalsContact O-CG 3.27Å; I140-H144 PolarHBondContact O-N 3.02Å; I140-H150 HydrophobicContact CD1-CB 4.29Å; I140-L153 HydrophobicContact CD1-CD1 3.6Å; I140-L153 HydrophobicContact CD1-CD2 3.91Å; I140-L153 HydrophobicContact CD1-CG 4.28Å; I140-L153 HydrophobicContact CG1-CD1 3.89Å; I140-I172 HydrophobicContact CD1-CD1 3.64Å; I140-I172 HydrophobicContact CD1-CG2 4.49Å; I140-I172 HydrophobicContact CG1-CD1 3.72Å; I140-D217 HydrophobicContact CG2-CB 4.38Å; I140-I218 HydrophobicContact CG2-CD1 4.38Å; I140-I221 HydrophobicContact CB-CD1 4Å; I140-I221 HydrophobicContact CG1-CD1 3.75Å; I140-I221 HydrophobicContact CG2-CD1 4Å; I140-A328 HydrophobicContact CG2-CB 4.28Å
141	H	98.4	Very high	96.2	Very high	52 Å²	52	26 Å²	26	24%	0.241	12%	0.117	C	C	.	.	H	α-helix	trans	-56.2	-48.1	173	177.3	29.3	0	0	0	110.8	L137 L143 H144 D145 A328 M332	L137-H141 VanDerWaalsContact O-CB 3.28Å; L137-H141 WeakPolarHBondContact O-CB 3.18Å; L137-H141 PolarHBondContact O-N 3.31Å; H141-L143 PolarHBondContact O-N 3.37Å; H141-H144 PolarHBondContact O-N 3.46Å; H141-D145 IonicContact CE1-OD1 3.52Å; H141-D145 PolarHBondContact CE1-OD1 2.9Å; H141-D145 VanDerWaalsContact CE1-OD1 3.28Å; H141-D145 IonicContact CE1-OD2 2.64Å; H141-D145 PolarHBondContact CE1-OD2 3.16Å; H141-D145 IonicContact ND1-OD1 3.9Å; H141-D145 PolarHBondContact ND1-OD1 2.79Å; H141-D145 IonicContact ND1-OD2 3.31Å; H141-D145 PolarHBondContact ND1-OD2 3.36Å; H141-D145 IonicContact NE2-OD2 3.4Å; H141-D145 WeakPolarHBondContact O-CB 3.3Å; H141-D145 PolarHBondContact O-N 3.15Å; H141-A328 HydrophobicContact CB-CB 3.79Å; H141-M332 HydrophobicContact CB-SD 4.15Å
142	Y	98.2	Very high	95.8	Very high	44 Å²	44	26.9 Å²	26.9	17%	0.173	12%	0.122	C	C	.	.	H	α-helix	trans	-57.8	-46	175.1	170.7	-99.2	0	0	0	112.7	L74 K75 H76 V79 N138 G139 I140 H144 D145 N146	L74-Y142 HydrophobicContact CB-CE1 4.29Å; L74-Y142 HydrophobicContact CD2-CD1 4.46Å; L74-Y142 HydrophobicContact CD2-CE1 3.51Å; L74-Y142 HydrophobicContact CG-CE1 4.48Å; K75-Y142 PolarHBondContact N-OH 2.93Å; H76-Y142 HydrophobicContact CB-CD1 3.4Å; H76-Y142 VanDerWaalsContact CB-CD1 3.4Å; H76-Y142 HydrophobicContact CB-CD2 4.06Å; H76-Y142 HydrophobicContact CB-CE1 3.59Å; H76-Y142 HydrophobicContact CB-CE2 4.24Å; H76-Y142 HydrophobicContact CB-CG 3.65Å; H76-Y142 AromaticContact CD2-CD2 3.86Å; H76-Y142 AromaticContact CD2-CG 3.65Å; H76-Y142 AromaticContact CG-CD1 3.84Å; H76-Y142 AromaticContact CG-CG 3.65Å; V79-Y142 HydrophobicContact CG2-CD1 3.98Å; N138-Y142 PolarHBondContact O-N 3.12Å; G139-Y142 PolarHBondContact O-N 3.27Å; I140-Y142 VanDerWaalsContact C-N 3.31Å; I140-Y142 PolarHBondContact O-N 3.31Å; Y142-H144 PolarHBondContact O-N 2.86Å; Y142-D145 PolarHBondContact O-N 2.88Å; Y142-N146 WeakPolarHBondContact CD2-ND2 3.26Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.49Å; Y142-N146 PolarHBondContact O-N 3.17Å; Y142-N146 VanDerWaalsContact O-N 3.11Å; Y142-N146 PolarHBondContact O-ND2 2.84Å
143	L	96.8	Very high	95.7	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.3	-45.6	176.3	-66.3	-175.3	0	0	0	111.4	L74 V79 G139 I140 H141 D145 N146 W147 I148 L175	L74-L143 HydrophobicContact CD1-CD2 3.88Å; L74-L143 HydrophobicContact CD2-CD2 3.91Å; V79-L143 HydrophobicContact CG1-CD2 4.25Å; V79-L143 HydrophobicContact CG2-CD2 3.98Å; V79-L143 HydrophobicContact CG2-CG 4.12Å; G139-L143 WeakPolarHBondContact O-CG 3.21Å; G139-L143 PolarHBondContact O-N 3.26Å; G139-L143 VanDerWaalsContact O-N 3.13Å; I140-L143 HydrophobicContact CD1-CD1 4.03Å; I140-L143 PolarHBondContact O-N 2.93Å; H141-L143 PolarHBondContact O-N 3.37Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 3.13Å; L143-N146 CarbonylContact O-C 3.5Å; L143-N146 PolarHBondContact O-N 2.91Å; L143-N146 VanDerWaalsContact O-N 3.14Å; L143-W147 PolarHBondContact O-N 3.24Å; L143-I148 CarbonylContact C-O 3.56Å; L143-I148 VanDerWaalsContact C-O 3.32Å; L143-I148 HydrophobicContact CB-CB 4.25Å; L143-I148 HydrophobicContact CB-CG2 4.4Å; L143-I148 HydrophobicContact CD2-CG2 4.33Å; L143-I148 WeakPolarHBondContact O-CA 3.48Å; L143-I148 WeakPolarHBondContact O-CB 3.42Å; L143-I148 PolarHBondContact O-N 2.92Å; L143-L175 HydrophobicContact CD1-CD2 4.17Å
144	H	95.7	Very high	95.5	Very high	3 Å²	3	29.8 Å²	29.8	1%	0.014	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-32.8	-178.9	-77.2	-169.3	0	0	0	113	I140 H141 Y142 W147 I148 K214 D217	I140-H144 WeakPolarHBondContact CG2-CE1 3.42Å; I140-H144 WeakPolarHBondContact CG2-NE2 3.37Å; I140-H144 VanDerWaalsContact O-CB 3.29Å; I140-H144 WeakPolarHBondContact O-CB 2.66Å; I140-H144 PolarHBondContact O-CD2 3.01Å; I140-H144 VanDerWaalsContact O-CG 3.27Å; I140-H144 PolarHBondContact O-N 3.02Å; H141-H144 PolarHBondContact O-N 3.46Å; Y142-H144 PolarHBondContact O-N 2.86Å; H144-W147 PolarHBondContact O-N 2.82Å; H144-I148 PolarHBondContact CD2-O 2.56Å; H144-K214 HydrophobicContact CB-CD 3.87Å; H144-K214 HydrophobicContact CB-CG 4.25Å; H144-K214 PolarHBondContact CE1-O 3.41Å; H144-K214 WeakPolarHBondContact O-CE 3.27Å; H144-K214 PolarHBondContact O-NZ 3.08Å; H144-D217 IonicContact CD2-OD2 2.86Å; H144-D217 IonicContact CE1-OD2 2.82Å; H144-D217 IonicContact NE2-OD2 3.98Å; H144-D217 PolarHBondContact NE2-OD2 3.28Å
145	D	95	Very high	95.4	Very high	87 Å²	87	26.1 Å²	26.1	47%	0.465	12%	0.12	S	C	.	.	H	α-helix	trans	-74	-31.2	174.9	-78.4	10.9	0	0	0	112	H141 Y142 L143 W147	H141-D145 IonicContact CE1-OD1 3.52Å; H141-D145 PolarHBondContact CE1-OD1 2.9Å; H141-D145 VanDerWaalsContact CE1-OD1 3.28Å; H141-D145 IonicContact CE1-OD2 2.64Å; H141-D145 PolarHBondContact CE1-OD2 3.16Å; H141-D145 IonicContact ND1-OD1 3.9Å; H141-D145 PolarHBondContact ND1-OD1 2.79Å; H141-D145 IonicContact ND1-OD2 3.31Å; H141-D145 PolarHBondContact ND1-OD2 3.36Å; H141-D145 IonicContact NE2-OD2 3.4Å; H141-D145 WeakPolarHBondContact O-CB 3.3Å; H141-D145 PolarHBondContact O-N 3.15Å; Y142-D145 PolarHBondContact O-N 2.88Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 3.13Å; D145-W147 PolarHBondContact O-N 3.12Å
146	N	93.1	Very high	95.2	Very high	71 Å²	71	27.7 Å²	27.7	38%	0.38	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	19.1	172	-71.1	-82	0	0	0	113	Y142 L143 I148	Y142-N146 WeakPolarHBondContact CD2-ND2 3.26Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.49Å; Y142-N146 PolarHBondContact O-N 3.17Å; Y142-N146 VanDerWaalsContact O-N 3.11Å; Y142-N146 PolarHBondContact O-ND2 2.84Å; L143-N146 CarbonylContact O-C 3.5Å; L143-N146 PolarHBondContact O-N 2.91Å; L143-N146 VanDerWaalsContact O-N 3.14Å; N146-I148 HydrophobicContact CB-CD1 4.18Å; N146-I148 WeakPolarHBondContact O-CG1 3.43Å; N146-I148 PolarHBondContact O-N 2.89Å
147	W	91.5	Very high	95	Very high	119 Å²	119	28.4 Å²	28.4	45%	0.451	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	30.9	176.5	-60.2	84.1	0	0	0	114.3	L143 H144 D145 L180 F181	L143-W147 PolarHBondContact O-N 3.24Å; H144-W147 PolarHBondContact O-N 2.82Å; D145-W147 PolarHBondContact O-N 3.12Å; W147-L180 CarbonylContact O-C 3.59Å; W147-L180 WeakPolarHBondContact O-CA 3.33Å; W147-F181 HydrophobicContact CB-CD1 4.38Å; W147-F181 HydrophobicContact CB-CE1 4.16Å; W147-F181 HydrophobicContact CB-CZ 4.22Å; W147-F181 WeakPolarHBondContact CB-O 3.48Å; W147-F181 HydrophobicContact CD2-CE2 4.02Å; W147-F181 HydrophobicContact CD2-CZ 4.14Å; W147-F181 AromaticContact CE3-CD2 3.5Å; W147-F181 HydrophobicContact CE3-CD2 3.5Å; W147-F181 VanDerWaalsContact CE3-CD2 3.5Å; W147-F181 AromaticContact CE3-CE2 3.08Å; W147-F181 HydrophobicContact CE3-CE2 3.08Å; W147-F181 HydrophobicContact CE3-CG 4.32Å; W147-F181 AromaticContact CE3-CZ 3.64Å; W147-F181 HydrophobicContact CE3-CZ 3.64Å; W147-F181 VanDerWaalsContact CE3-O 3.31Å; W147-F181 HydrophobicContact CG-CZ 4.43Å; W147-F181 AromaticContact CZ3-CD2 3.94Å; W147-F181 HydrophobicContact CZ3-CD2 3.94Å; W147-F181 AromaticContact CZ3-CE2 3.45Å; W147-F181 HydrophobicContact CZ3-CE2 3.45Å; W147-F181 VanDerWaalsContact CZ3-CE2 3.45Å; W147-F181 HydrophobicContact CZ3-CZ 4.31Å; W147-F181 WeakPolarHBondContact O-CD1 3.34Å; W147-F181 WeakPolarHBondContact O-CE1 3.37Å; W147-F181 PolarHBondContact O-N 3.19Å
148	I	91.7	Very high	95	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.026	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.5	179.6	-65.2	157.9	0	0	0	110.1	L70 L74 L143 H144 N146 A178 R179 L180	L70-I148 HydrophobicContact CD2-CD1 3.91Å; L70-I148 HydrophobicContact CD2-CG1 4.03Å; L74-I148 HydrophobicContact CD1-CD1 4.14Å; L74-I148 HydrophobicContact CD2-CD1 3.52Å; L74-I148 HydrophobicContact CG-CD1 4.21Å; L143-I148 CarbonylContact C-O 3.56Å; L143-I148 VanDerWaalsContact C-O 3.32Å; L143-I148 HydrophobicContact CB-CB 4.25Å; L143-I148 HydrophobicContact CB-CG2 4.4Å; L143-I148 HydrophobicContact CD2-CG2 4.33Å; L143-I148 WeakPolarHBondContact O-CA 3.48Å; L143-I148 WeakPolarHBondContact O-CB 3.42Å; L143-I148 PolarHBondContact O-N 2.92Å; H144-I148 PolarHBondContact CD2-O 2.56Å; N146-I148 HydrophobicContact CB-CD1 4.18Å; N146-I148 WeakPolarHBondContact O-CG1 3.43Å; N146-I148 PolarHBondContact O-N 2.89Å; I148-A178 HydrophobicContact CG2-CB 4Å; I148-R179 WeakPolarHBondContact CA-O 3.36Å; I148-L180 HydrophobicContact CD1-CD2 4.41Å; I148-L180 HydrophobicContact CG1-CD2 3.66Å
149	L	91.8	Very high	95	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.2	166.6	-57.2	-179	0	0	0	109.5	R151 A178 R179 F181 K214	L149-R151 HydrophobicContact CB-CG 3.7Å; L149-A178 WeakPolarHBondContact O-CA 3.24Å; L149-R179 PolarHBondContact N-O 2.73Å; L149-R179 PolarHBondContact O-N 2.97Å; L149-R179 VanDerWaalsContact O-N 3.12Å; L149-F181 HydrophobicContact CD1-CB 4.33Å; L149-F181 HydrophobicContact CD1-CD1 4.26Å; L149-F181 HydrophobicContact CD1-CG 4.44Å; L149-F181 HydrophobicContact CD2-CD1 3.69Å; L149-F181 HydrophobicContact CD2-CE1 3.71Å; L149-F181 HydrophobicContact CD2-CG 4.45Å; L149-F181 HydrophobicContact CG-CB 4.4Å; L149-F181 HydrophobicContact CG-CD1 3.51Å; L149-F181 HydrophobicContact CG-CE1 4.06Å; L149-F181 HydrophobicContact CG-CG 4.17Å; L149-K214 HydrophobicContact CD2-CB 4.37Å; L149-K214 HydrophobicContact CD2-CG 3.89Å
150	H	92.3	Very high	95	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.			trans	-78.1	-48.6	177.5	-171.7	-76	0	0	0	111.6	I140 D152 L153 G173 F177 D217	I140-H150 HydrophobicContact CD1-CB 4.29Å; H150-D152 PolarHBondContact CE1-O 3.21Å; H150-D152 VanDerWaalsContact CE1-O 3.27Å; H150-D152 VanDerWaalsContact ND1-C 3.28Å; H150-D152 PolarHBondContact ND1-N 3.49Å; H150-D152 PolarHBondContact ND1-O 2.83Å; H150-D152 PolarHBondContact O-N 3.46Å; H150-D152 VanDerWaalsContact O-N 3.12Å; H150-L153 HydrophobicContact CB-CD1 4.32Å; H150-L153 HydrophobicContact CB-CD2 4.11Å; H150-L153 HydrophobicContact CB-CG 3.88Å; H150-L153 PolarHBondContact ND1-N 3.39Å; H150-G173 PolarHBondContact NE2-O 3.1Å; H150-F177 CarbonylContact O-C 3.55Å; H150-D217 PolarHBondContact N-OD2 3.26Å
151	R	89.9	Confident	95	Very high	35 Å²	35	28.9 Å²	28.9	13%	0.132	14%	0.14	C	C	.	.			trans	70.5	-13.2	174.9	-47.1	-167.2	-66.4	145.4	17.8	117.3	L149 F177 R179 D192 Y212 I216 D217	L149-R151 HydrophobicContact CB-CG 3.7Å; R151-F177 HydrophobicContact CB-CB 4.36Å; R151-F177 PolarHBondContact NE-O 3.21Å; R151-F177 PolarHBondContact NH2-O 2.75Å; R151-R179 VanDerWaalsContact NH2-CG 3.32Å; R151-D192 IonicContact CZ-OD1 3.96Å; R151-D192 IonicContact CZ-OD2 3.63Å; R151-D192 IonicContact NH1-OD1 3.3Å; R151-D192 PolarHBondContact NH1-OD1 3.35Å; R151-D192 IonicContact NH1-OD2 3.49Å; R151-D192 PolarHBondContact NH1-OD2 2.97Å; R151-D192 IonicContact NH2-OD1 3.67Å; R151-D192 PolarHBondContact NH2-OD1 3.39Å; R151-D192 IonicContact NH2-OD2 2.57Å; R151-Y212 VanDerWaalsContact CD-CD2 3.5Å; R151-Y212 HydrophobicContact CG-CD1 4.4Å; R151-Y212 HydrophobicContact CG-CG 4.36Å; R151-I216 HydrophobicContact CB-CD1 4.41Å; R151-I216 HydrophobicContact CG-CD1 4.01Å; R151-D217 PolarHBondContact N-OD1 3.4Å
152	D	89.7	Confident	94.9	Very high	17 Å²	17	26.8 Å²	26.8	9%	0.091	13%	0.133	C	C	.	.			trans	-134.1	47.8	175.4	-173.4	38.6	0	0	0	112.1	H150 K154 N157 F177	H150-D152 PolarHBondContact CE1-O 3.21Å; H150-D152 VanDerWaalsContact CE1-O 3.27Å; H150-D152 VanDerWaalsContact ND1-C 3.28Å; H150-D152 PolarHBondContact ND1-N 3.49Å; H150-D152 PolarHBondContact ND1-O 2.83Å; H150-D152 PolarHBondContact O-N 3.46Å; H150-D152 VanDerWaalsContact O-N 3.12Å; D152-K154 VanDerWaalsContact CG-NZ 3.28Å; D152-K154 PolarHBondContact O-N 3.03Å; D152-K154 IonicContact OD1-NZ 3.49Å; D152-K154 PolarHBondContact OD1-NZ 3.35Å; D152-K154 VanDerWaalsContact OD1-NZ 3.09Å; D152-K154 WeakPolarHBondContact OD2-CE 3.5Å; D152-K154 IonicContact OD2-NZ 2.92Å; D152-K154 PolarHBondContact OD2-NZ 3.37Å; D152-N157 PolarHBondContact O-ND2 3.38Å; D152-N157 PolarHBondContact OD2-ND2 3.23Å; D152-F177 HydrophobicContact CB-CB 4.04Å; D152-F177 HydrophobicContact CB-CD2 3.32Å; D152-F177 HydrophobicContact CB-CE2 3.76Å; D152-F177 HydrophobicContact CB-CG 3.89Å; D152-F177 WeakPolarHBondContact OD2-CD2 3.22Å; D152-F177 WeakPolarHBondContact OD2-CE2 3.45Å
153	L	95.3	Very high	94.8	Very high	4 Å²	4	31 Å²	31	2%	0.021	15%	0.154	C	C	.	.			trans	-72.4	126.7	174.7	-71.5	171.1	0	0	0	110.2	I140 H150 I158 I172 Y200 D217 A220 I221 I224	I140-L153 HydrophobicContact CD1-CD1 3.6Å; I140-L153 HydrophobicContact CD1-CD2 3.91Å; I140-L153 HydrophobicContact CD1-CG 4.28Å; I140-L153 HydrophobicContact CG1-CD1 3.89Å; H150-L153 HydrophobicContact CB-CD1 4.32Å; H150-L153 HydrophobicContact CB-CD2 4.11Å; H150-L153 HydrophobicContact CB-CG 3.88Å; H150-L153 PolarHBondContact ND1-N 3.39Å; L153-I158 HydrophobicContact CD2-CD1 3.91Å; L153-I172 HydrophobicContact CD2-CG2 4.08Å; L153-Y200 WeakPolarHBondContact O-CB 3.04Å; L153-D217 HydrophobicContact CD1-CB 3.73Å; L153-A220 HydrophobicContact CB-CB 3.73Å; L153-I221 HydrophobicContact CD1-CD1 4.22Å; L153-I221 HydrophobicContact CD1-CG1 3.9Å; L153-I224 HydrophobicContact CB-CD1 4.37Å
154	K	94.9	Very high	94.8	Very high	59 Å²	59	33 Å²	33	26%	0.257	18%	0.175	S	C	.	.			trans	-159.8	161.1	177.3	62	-165.3	177.5	-148.1	0	108.9	D152 A156 N157 Y200	D152-K154 VanDerWaalsContact CG-NZ 3.28Å; D152-K154 PolarHBondContact O-N 3.03Å; D152-K154 IonicContact OD1-NZ 3.49Å; D152-K154 PolarHBondContact OD1-NZ 3.35Å; D152-K154 VanDerWaalsContact OD1-NZ 3.09Å; D152-K154 WeakPolarHBondContact OD2-CE 3.5Å; D152-K154 IonicContact OD2-NZ 2.92Å; D152-K154 PolarHBondContact OD2-NZ 3.37Å; K154-A156 HydrophobicContact CG-CB 4.41Å; K154-A156 PolarHBondContact O-N 3.44Å; K154-A156 VanDerWaalsContact O-N 3.08Å; K154-N157 WeakPolarHBondContact CE-ND2 3.39Å; K154-N157 HydrophobicContact CG-CB 4.3Å; K154-N157 PolarHBondContact O-N 3.25Å; K154-Y200 HydrophobicContact CB-CD2 3.63Å; K154-Y200 HydrophobicContact CB-CE2 3.75Å; K154-Y200 HydrophobicContact CB-CG 4.11Å
155	P	97	Very high	94.7	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-52.7	-35.6	-176.5	-30.5	36.4	0	0	0	114.8	L105 W106 I109 N157 I158 Y200 I224 E227	L105-P155 HydrophobicContact CB-CB 3.79Å; L105-P155 WeakPolarHBondContact CB-O 3.29Å; L105-P155 PolarHBondContact N-O 3.32Å; W106-P155 HydrophobicContact CB-CB 4.02Å; W106-P155 PolarHBondContact N-O 3.35Å; I109-P155 HydrophobicContact CD1-CB 4.04Å; I109-P155 HydrophobicContact CD1-CG 4.04Å; P155-N157 PolarHBondContact O-N 2.84Å; P155-I158 PolarHBondContact O-N 3.38Å; P155-Y200 VanDerWaalsContact CD-CE1 3.42Å; P155-Y200 WeakPolarHBondContact CD-OH 3.06Å; P155-Y200 HydrophobicContact CG-CE1 4.01Å; P155-Y200 WeakPolarHBondContact CG-OH 3.3Å; P155-I224 HydrophobicContact CG-CG1 4.32Å; P155-E227 WeakPolarHBondContact CG-OE2 3.47Å
156	A	93.9	Very high	94.8	Very high	42 Å²	42	36.3 Å²	36.3	35%	0.347	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-65.7	-23.3	178.5	0	0	0	0	0	113.8	W106 K154	W106-A156 HydrophobicContact CB-CB 4.17Å; K154-A156 HydrophobicContact CG-CB 4.41Å; K154-A156 PolarHBondContact O-N 3.44Å; K154-A156 VanDerWaalsContact O-N 3.08Å
157	N	95.7	Very high	95	Very high	14 Å²	14	34.8 Å²	34.8	8%	0.075	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-96	-1.1	179.6	-67.8	-5.3	0	0	0	112.4	D152 K154 P155 G173	D152-N157 PolarHBondContact O-ND2 3.38Å; D152-N157 PolarHBondContact OD2-ND2 3.23Å; K154-N157 WeakPolarHBondContact CE-ND2 3.39Å; K154-N157 HydrophobicContact CG-CB 4.3Å; K154-N157 PolarHBondContact O-N 3.25Å; P155-N157 PolarHBondContact O-N 2.84Å; N157-G173 PolarHBondContact O-N 3.33Å
158	I	98.3	Very high	95.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	95.4	174	-51.2	-57.2	0	0	0	108.3	D104 L105 I136 L153 P155 V170 I172 I224	D104-I158 CarbonylContact C-O 2.93Å; D104-I158 VanDerWaalsContact CA-O 3.28Å; D104-I158 WeakPolarHBondContact CA-O 3.3Å; D104-I158 WeakPolarHBondContact CB-O 3.24Å; L105-I158 HydrophobicContact CB-CB 4.32Å; L105-I158 HydrophobicContact CD1-CB 3.74Å; L105-I158 HydrophobicContact CD1-CG1 4.19Å; L105-I158 HydrophobicContact CD1-CG2 3.57Å; L105-I158 HydrophobicContact CG-CB 3.8Å; L105-I158 HydrophobicContact CG-CG2 3.72Å; L105-I158 PolarHBondContact N-O 3.24Å; I136-I158 HydrophobicContact CD1-CG2 3.94Å; I136-I158 HydrophobicContact CG1-CG2 3.8Å; I136-I158 HydrophobicContact CG2-CD1 4.47Å; L153-I158 HydrophobicContact CD2-CD1 3.91Å; P155-I158 PolarHBondContact O-N 3.38Å; I158-V170 HydrophobicContact CG2-CG1 3.62Å; I158-I172 HydrophobicContact CD1-CG1 4.16Å; I158-I224 HydrophobicContact CG1-CD1 4.12Å
159	L	98.4	Very high	95.6	Very high	29 Å²	29	32.1 Å²	32.1	15%	0.152	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	153.7	-178.9	-46.8	177	0	0	0	110.5	I80 A101 H103 D104 V170 K171	I80-L159 HydrophobicContact CD1-CD1 3.89Å; A101-L159 HydrophobicContact CB-CB 3.62Å; A101-L159 HydrophobicContact CB-CD1 4.04Å; A101-L159 HydrophobicContact CB-CG 4.37Å; H103-L159 WeakPolarHBondContact O-CA 3.18Å; D104-L159 HydrophobicContact CB-CD2 3.94Å; L159-V170 CarbonylContact O-C 3.6Å; L159-V170 VanDerWaalsContact O-CA 3.32Å; L159-V170 WeakPolarHBondContact O-CA 3.25Å; L159-K171 HydrophobicContact CB-CB 4.27Å; L159-K171 WeakPolarHBondContact CB-O 3.34Å; L159-K171 PolarHBondContact N-O 2.89Å; L159-K171 PolarHBondContact O-N 3.28Å
160	V	98.6	Very high	96	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.5	174.3	-173.4	0	0	0	0	108.8	H103 L105 I108 L132 V170 V347 F348	H103-V160 HydrophobicContact CB-CB 4.22Å; H103-V160 PolarHBondContact N-O 3.42Å; H103-V160 VanDerWaalsContact N-O 3.08Å; H103-V160 PolarHBondContact O-N 3.39Å; L105-V160 HydrophobicContact CD2-CG2 4.22Å; I108-V160 HydrophobicContact CD1-CB 4.41Å; I108-V160 HydrophobicContact CD1-CG2 4.1Å; L132-V160 HydrophobicContact CD2-CG2 3.95Å; V160-V170 HydrophobicContact CG2-CG2 4.49Å; V160-V347 HydrophobicContact CG1-CG2 3.83Å; V160-F348 HydrophobicContact CB-CZ 4.41Å; V160-F348 HydrophobicContact CG1-CE1 4.25Å; V160-F348 HydrophobicContact CG1-CE2 3.9Å; V160-F348 HydrophobicContact CG1-CZ 3.45Å; V160-F348 VanDerWaalsContact CG1-CZ 3.45Å
161	M	98.4	Very high	96.3	Very high	21 Å²	21	32.6 Å²	32.6	10%	0.103	18%	0.18	C	C	.	.			trans	-66.2	136.5	179.4	-60.3	-59.3	-68.6	0	0	110.5	D99 F100 A101 D166 G168 R169 K171	D99-M161 HydrophobicContact CB-CE 4.1Å; F100-M161 WeakPolarHBondContact O-CE 3.41Å; A101-M161 HydrophobicContact CB-SD 3.89Å; M161-D166 HydrophobicContact CB-CB 4.3Å; M161-D166 WeakPolarHBondContact CB-O 3.47Å; M161-D166 HydrophobicContact CE-CB 4.36Å; M161-D166 HydrophobicContact CG-CB 4Å; M161-G168 PolarHBondContact O-N 2.89Å; M161-R169 HydrophobicContact CG-CB 4.24Å; M161-R169 WeakPolarHBondContact CG-O 3.29Å; M161-R169 PolarHBondContact N-O 3.19Å; M161-K171 HydrophobicContact CG-CG 3.97Å; M161-K171 HydrophobicContact SD-CG 3.76Å
162	G	97.7	Very high	96.7	Very high	8 Å²	8	31 Å²	31	8%	0.082	17%	0.174	C	C	.	.			trans	-78.5	-147.3	175.6	0	0	0	0	0	112	R167	G162-R167 VanDerWaalsContact O-CA 3.32Å; G162-R167 WeakPolarHBondContact O-CA 3.48Å
163	E	96.3	Very high	96.8	Very high	132 Å²	132	30.3 Å²	30.3	62%	0.617	17%	0.171	S	C	*	.	S	Bend	trans	-63.1	140.6	173.9	-61.8	-61.8	166.7	0	0	111.6	R167 I353	E163-R167 IonicContact OE1-CZ 3.63Å; E163-R167 IonicContact OE1-NE 3.76Å; E163-R167 PolarHBondContact OE1-NE 3.45Å; E163-R167 IonicContact OE1-NH2 3.24Å; E163-R167 PolarHBondContact OE1-NH2 2.78Å; E163-R167 IonicContact OE2-CZ 2.68Å; E163-R167 IonicContact OE2-NE 3.11Å; E163-R167 PolarHBondContact OE2-NE 2.9Å; E163-R167 IonicContact OE2-NH2 2.77Å; E163-I353 HydrophobicContact CG-CD1 4.24Å
164	G	94.9	Very high	96.2	Very high	43 Å²	43	31.6 Å²	31.6	44%	0.443	18%	0.178	S	C	.	.	S	Bend	trans	142.1	-171.9	-178.3	0	0	0	0	0	113.6	D166 R167	G164-D166 PolarHBondContact O-N 3.14Å; G164-R167 WeakPolarHBondContact O-CB 3.48Å; G164-R167 PolarHBondContact O-N 3.23Å
165	P	94.3	Very high	95.4	Very high	120 Å²	120	28.9 Å²	28.9	78%	0.779	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.5	-177	25.3	-34.5	0	0	0	113.7
166	D	96.3	Very high	94	Very high	39 Å²	39	29 Å²	29	21%	0.209	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	24.2	179.7	-88.4	15.9	0	0	0	112.2	M161 G164 G168 R169 K171	M161-D166 HydrophobicContact CB-CB 4.3Å; M161-D166 WeakPolarHBondContact CB-O 3.47Å; M161-D166 HydrophobicContact CE-CB 4.36Å; M161-D166 HydrophobicContact CG-CB 4Å; G164-D166 PolarHBondContact O-N 3.14Å; D166-G168 PolarHBondContact O-N 3.28Å; D166-R169 HydrophobicContact CB-CB 4.35Å; D166-R169 WeakPolarHBondContact O-CB 3.47Å; D166-R169 PolarHBondContact O-N 3.24Å; D166-R169 IonicContact OD1-CZ 2.89Å; D166-R169 IonicContact OD1-NH1 3.89Å; D166-R169 PolarHBondContact OD1-NH1 2.84Å; D166-R169 IonicContact OD1-NH2 2.95Å; D166-R169 IonicContact OD2-CZ 3.09Å; D166-R169 IonicContact OD2-NH1 3.81Å; D166-R169 PolarHBondContact OD2-NH1 2.75Å; D166-R169 VanDerWaalsContact OD2-NH1 3.07Å; D166-K171 WeakPolarHBondContact OD2-CE 3.41Å; D166-K171 IonicContact OD2-NZ 2.65Å; D166-K171 PolarHBondContact OD2-NZ 3.08Å
167	R	98	Very high	92.8	Very high	40 Å²	40	27.5 Å²	27.5	15%	0.151	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.5	127.7	-174.1	-171.9	-176.1	-160.9	-91.9	-0.5	113.6	G162 E163 G164 R169 D346 L351	G162-R167 VanDerWaalsContact O-CA 3.32Å; G162-R167 WeakPolarHBondContact O-CA 3.48Å; E163-R167 IonicContact OE1-CZ 3.63Å; E163-R167 IonicContact OE1-NE 3.76Å; E163-R167 PolarHBondContact OE1-NE 3.45Å; E163-R167 IonicContact OE1-NH2 3.24Å; E163-R167 PolarHBondContact OE1-NH2 2.78Å; E163-R167 IonicContact OE2-CZ 2.68Å; E163-R167 IonicContact OE2-NE 3.11Å; E163-R167 PolarHBondContact OE2-NE 2.9Å; E163-R167 IonicContact OE2-NH2 2.77Å; G164-R167 WeakPolarHBondContact O-CB 3.48Å; G164-R167 PolarHBondContact O-N 3.23Å; R167-R169 PolarHBondContact O-N 3.03Å; R167-R169 VanDerWaalsContact O-N 3.1Å; R167-D346 IonicContact CZ-OD2 3.28Å; R167-D346 IonicContact NH1-OD1 3.88Å; R167-D346 IonicContact NH1-OD2 3.74Å; R167-D346 PolarHBondContact NH1-OD2 3.38Å; R167-L351 PolarHBondContact NH1-O 3.29Å; R167-L351 PolarHBondContact NH2-O 2.93Å
168	G	98.3	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	6.8	177.2	0	0	0	0	0	114.8	M161 D166 D346 V347	M161-G168 PolarHBondContact O-N 2.89Å; D166-G168 PolarHBondContact O-N 3.28Å; G168-D346 WeakPolarHBondContact CA-OD1 3.43Å; G168-V347 VanDerWaalsContact O-CG1 3.28Å; G168-V347 WeakPolarHBondContact O-CG1 3.49Å; G168-V347 WeakPolarHBondContact O-CG2 3.45Å; G168-V347 PolarHBondContact O-N 3.5Å
169	R	98.7	Very high	90.2	Very high	67 Å²	67	27.9 Å²	27.9	25%	0.253	15%	0.154	S	C	.	.			trans	-73	132.5	176.3	-170.4	168.9	-66.3	155.5	8	110.4	P77 M161 D166 R167	P77-R169 VanDerWaalsContact O-CD 3.26Å; P77-R169 WeakPolarHBondContact O-CD 3.35Å; M161-R169 HydrophobicContact CG-CB 4.24Å; M161-R169 WeakPolarHBondContact CG-O 3.29Å; M161-R169 PolarHBondContact N-O 3.19Å; D166-R169 HydrophobicContact CB-CB 4.35Å; D166-R169 WeakPolarHBondContact O-CB 3.47Å; D166-R169 PolarHBondContact O-N 3.24Å; D166-R169 IonicContact OD1-CZ 2.89Å; D166-R169 IonicContact OD1-NH1 3.89Å; D166-R169 PolarHBondContact OD1-NH1 2.84Å; D166-R169 IonicContact OD1-NH2 2.95Å; D166-R169 IonicContact OD2-CZ 3.09Å; D166-R169 IonicContact OD2-NH1 3.81Å; D166-R169 PolarHBondContact OD2-NH1 2.75Å; D166-R169 VanDerWaalsContact OD2-NH1 3.07Å; R167-R169 PolarHBondContact O-N 3.03Å; R167-R169 VanDerWaalsContact O-N 3.1Å
170	V	98.8	Very high	88.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.7	171.3	174.4	0	0	0	0	109.4	N78 L132 Q135 I136 I158 L159 V160 V347	N78-V170 VanDerWaalsContact CA-O 3.24Å; N78-V170 WeakPolarHBondContact CA-O 3.47Å; N78-V170 PolarHBondContact ND2-O 2.99Å; N78-V170 VanDerWaalsContact ND2-O 3.08Å; L132-V170 HydrophobicContact CD2-CG2 3.64Å; Q135-V170 HydrophobicContact CB-CB 3.82Å; Q135-V170 HydrophobicContact CB-CG2 3.77Å; I136-V170 HydrophobicContact CG1-CG1 4.04Å; I158-V170 HydrophobicContact CG2-CG1 3.62Å; L159-V170 CarbonylContact O-C 3.6Å; L159-V170 VanDerWaalsContact O-CA 3.32Å; L159-V170 WeakPolarHBondContact O-CA 3.25Å; V160-V170 HydrophobicContact CG2-CG2 4.49Å; V170-V347 HydrophobicContact CG2-CG1 4.41Å
171	K	98.4	Very high	87.3	Confident	14 Å²	14	30.3 Å²	30.3	6%	0.061	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	113.3	168.7	-55.2	-69.9	-176.8	175.9	0	108.8	P77 I80 L159 M161 D166 G173	P77-K171 WeakPolarHBondContact O-CD 3.44Å; P77-K171 PolarHBondContact O-NZ 3.21Å; I80-K171 HydrophobicContact CB-CB 4.46Å; L159-K171 HydrophobicContact CB-CB 4.27Å; L159-K171 WeakPolarHBondContact CB-O 3.34Å; L159-K171 PolarHBondContact N-O 2.89Å; L159-K171 PolarHBondContact O-N 3.28Å; M161-K171 HydrophobicContact CG-CG 3.97Å; M161-K171 HydrophobicContact SD-CG 3.76Å; D166-K171 WeakPolarHBondContact OD2-CE 3.41Å; D166-K171 IonicContact OD2-NZ 2.65Å; D166-K171 PolarHBondContact OD2-NZ 3.08Å; K171-G173 PolarHBondContact O-N 3.06Å
172	I	98.2	Very high	85.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	118	171.4	-61	171.2	0	0	0	107.8	N78 I80 I140 L153 I158	N78-I172 WeakPolarHBondContact O-CB 3.39Å; N78-I172 WeakPolarHBondContact O-CG1 3.47Å; N78-I172 PolarHBondContact O-N 3.29Å; I80-I172 WeakPolarHBondContact CB-O 3.11Å; I80-I172 WeakPolarHBondContact CG2-O 3.33Å; I80-I172 PolarHBondContact N-O 2.84Å; I140-I172 HydrophobicContact CD1-CD1 3.64Å; I140-I172 HydrophobicContact CD1-CG2 4.49Å; I140-I172 HydrophobicContact CG1-CD1 3.72Å; L153-I172 HydrophobicContact CD2-CG2 4.08Å; I158-I172 HydrophobicContact CD1-CG1 4.16Å
173	G	91.8	Very high	83	Confident	3 Å²	3	42.8 Å²	42.8	3%	0.031	22%	0.217	C	C	.	.			trans	-111.3	176.4	-177.4	0	0	0	0	0	113.1	H150 N157 K171	H150-G173 PolarHBondContact NE2-O 3.1Å; N157-G173 PolarHBondContact O-N 3.33Å; K171-G173 PolarHBondContact O-N 3.06Å
174	D	83.1	Confident	80.9	Confident	32 Å²	32	42.2 Å²	42.2	17%	0.171	22%	0.224	C	C	.	.			trans	55.1	70.8	177.3	-159.2	10.2	0	0	0	116	Y33 K53 G176	Y33-D174 WeakPolarHBondContact CD2-OD2 3.29Å; Y33-D174 WeakPolarHBondContact CE2-OD2 3.32Å; K53-D174 IonicContact NZ-OD1 2.73Å; K53-D174 PolarHBondContact NZ-OD1 3.01Å; D174-G176 PolarHBondContact O-N 3.19Å; D174-G176 PolarHBondContact OD1-N 3.01Å
175	L	78.5	Confident	79.1	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-80.5	19.2	172.4	-59.8	-176.8	0	0	0	112.9	L71 L74 L143 F177 A178	L71-L175 HydrophobicContact CD2-CD1 3.66Å; L71-L175 HydrophobicContact CD2-CG 4.39Å; L71-L175 HydrophobicContact CG-CD1 4.19Å; L74-L175 HydrophobicContact CD1-CD1 3.45Å; L74-L175 VanDerWaalsContact CD1-CD1 3.45Å; L143-L175 HydrophobicContact CD1-CD2 4.17Å; L175-F177 PolarHBondContact O-N 2.96Å; L175-A178 HydrophobicContact CB-CB 3.72Å; L175-A178 HydrophobicContact CD2-CB 4.07Å; L175-A178 HydrophobicContact CG-CB 4.39Å; L175-A178 VanDerWaalsContact O-CB 3.24Å; L175-A178 WeakPolarHBondContact O-CB 3.28Å; L175-A178 PolarHBondContact O-N 3.08Å
176	G	67.7	Low	77.3	Confident	3 Å²	3	43 Å²	43	3%	0.031	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-58.4	-34.2	179.1	0	0	0	0	0	112.7	R66 D174	R66-G176 PolarHBondContact NH2-O 3.27Å; D174-G176 PolarHBondContact O-N 3.19Å; D174-G176 PolarHBondContact OD1-N 3.01Å
177	F	69.1	Low	75.5	Confident	12 Å²	12	44.9 Å²	44.9	5%	0.053	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-89.8	-1.7	171.2	-67.7	-85.1	0	0	0	113.8	Y33 H150 R151 D152 L175 R179 P193 V195	Y33-F177 HydrophobicContact CE2-CD2 4.42Å; Y33-F177 AromaticContact CE2-CE2 3.98Å; Y33-F177 HydrophobicContact CE2-CE2 3.98Å; Y33-F177 AromaticContact CZ-CD2 3.9Å; Y33-F177 AromaticContact CZ-CE2 3.55Å; Y33-F177 VanDerWaalsContact OH-CD2 3.3Å; Y33-F177 WeakPolarHBondContact OH-CD2 3.43Å; Y33-F177 WeakPolarHBondContact OH-CE2 3.33Å; Y33-F177 WeakPolarHBondContact OH-CZ 3.23Å; H150-F177 CarbonylContact O-C 3.55Å; R151-F177 HydrophobicContact CB-CB 4.36Å; R151-F177 PolarHBondContact NE-O 3.21Å; R151-F177 PolarHBondContact NH2-O 2.75Å; D152-F177 HydrophobicContact CB-CB 4.04Å; D152-F177 HydrophobicContact CB-CD2 3.32Å; D152-F177 HydrophobicContact CB-CE2 3.76Å; D152-F177 HydrophobicContact CB-CG 3.89Å; D152-F177 WeakPolarHBondContact OD2-CD2 3.22Å; D152-F177 WeakPolarHBondContact OD2-CE2 3.45Å; L175-F177 PolarHBondContact O-N 2.96Å; F177-R179 PolarHBondContact O-NH1 3.34Å; F177-P193 HydrophobicContact CD1-CG 4.35Å; F177-P193 HydrophobicContact CE1-CB 3.93Å; F177-P193 VanDerWaalsContact CE1-CD 3.47Å; F177-P193 HydrophobicContact CE1-CG 3.69Å; F177-P193 HydrophobicContact CZ-CB 4.13Å; F177-P193 HydrophobicContact CZ-CG 4.16Å; F177-V195 HydrophobicContact CE1-CG2 4.19Å; F177-V195 HydrophobicContact CZ-CG2 4.18Å
178	A	66.1	Low	73.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.			trans	-64.6	146	-176.2	0	0	0	0	0	111.9	R66 L70 I148 L149 L175	R66-A178 VanDerWaalsContact CD-O 3.3Å; R66-A178 WeakPolarHBondContact CD-O 2.99Å; R66-A178 PolarHBondContact NE-O 3.39Å; L70-A178 HydrophobicContact CD1-CB 3.68Å; I148-A178 HydrophobicContact CG2-CB 4Å; L149-A178 WeakPolarHBondContact O-CA 3.24Å; L175-A178 HydrophobicContact CB-CB 3.72Å; L175-A178 HydrophobicContact CD2-CB 4.07Å; L175-A178 HydrophobicContact CG-CB 4.39Å; L175-A178 VanDerWaalsContact O-CB 3.24Å; L175-A178 WeakPolarHBondContact O-CB 3.28Å; L175-A178 PolarHBondContact O-N 3.08Å
179	R	73	Confident	71.5	Confident	22 Å²	22	48.8 Å²	48.8	8%	0.083	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139	174.2	-69.3	-68	-179.2	-70.6	-1.1	110	R66 I148 L149 R151 F177 F181 L191 D192	R66-R179 VanDerWaalsContact NH1-CZ 3.32Å; I148-R179 WeakPolarHBondContact CA-O 3.36Å; L149-R179 PolarHBondContact N-O 2.73Å; L149-R179 PolarHBondContact O-N 2.97Å; L149-R179 VanDerWaalsContact O-N 3.12Å; R151-R179 VanDerWaalsContact NH2-CG 3.32Å; F177-R179 PolarHBondContact O-NH1 3.34Å; R179-F181 PolarHBondContact O-N 3.44Å; R179-L191 PolarHBondContact NH2-O 2.94Å; R179-D192 IonicContact NH2-OD1 2.73Å
180	L	67.9	Low	69.4	Low	58 Å²	58	51.8 Å²	51.8	30%	0.304	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	125.1	158.9	-68.9	164.4	0	0	0	108.2	L70 W147 I148 Y182	L70-L180 HydrophobicContact CD2-CD1 4.28Å; L70-L180 HydrophobicContact CD2-CD2 4.13Å; L70-L180 HydrophobicContact CD2-CG 3.96Å; W147-L180 CarbonylContact O-C 3.59Å; W147-L180 WeakPolarHBondContact O-CA 3.33Å; I148-L180 HydrophobicContact CD1-CD2 4.41Å; I148-L180 HydrophobicContact CG1-CD2 3.66Å; L180-Y182 HydrophobicContact CB-CD2 4.38Å; L180-Y182 HydrophobicContact CB-CE2 3.78Å; L180-Y182 HydrophobicContact CD1-CE2 4.24Å
181	F	67.9	Low	67.2	Low	21 Å²	21	56.1 Å²	56.1	9%	0.092	30%	0.301	C	S	.	.			trans	-98.9	123	165.7	67.2	-80.3	0	0	0	107.4	W147 L149 R179 K214	W147-F181 HydrophobicContact CB-CD1 4.38Å; W147-F181 HydrophobicContact CB-CE1 4.16Å; W147-F181 HydrophobicContact CB-CZ 4.22Å; W147-F181 WeakPolarHBondContact CB-O 3.48Å; W147-F181 HydrophobicContact CD2-CE2 4.02Å; W147-F181 HydrophobicContact CD2-CZ 4.14Å; W147-F181 AromaticContact CE3-CD2 3.5Å; W147-F181 HydrophobicContact CE3-CD2 3.5Å; W147-F181 VanDerWaalsContact CE3-CD2 3.5Å; W147-F181 AromaticContact CE3-CE2 3.08Å; W147-F181 HydrophobicContact CE3-CE2 3.08Å; W147-F181 HydrophobicContact CE3-CG 4.32Å; W147-F181 AromaticContact CE3-CZ 3.64Å; W147-F181 HydrophobicContact CE3-CZ 3.64Å; W147-F181 VanDerWaalsContact CE3-O 3.31Å; W147-F181 HydrophobicContact CG-CZ 4.43Å; W147-F181 AromaticContact CZ3-CD2 3.94Å; W147-F181 HydrophobicContact CZ3-CD2 3.94Å; W147-F181 AromaticContact CZ3-CE2 3.45Å; W147-F181 HydrophobicContact CZ3-CE2 3.45Å; W147-F181 VanDerWaalsContact CZ3-CE2 3.45Å; W147-F181 HydrophobicContact CZ3-CZ 4.31Å; W147-F181 WeakPolarHBondContact O-CD1 3.34Å; W147-F181 WeakPolarHBondContact O-CE1 3.37Å; W147-F181 PolarHBondContact O-N 3.19Å; L149-F181 HydrophobicContact CD1-CB 4.33Å; L149-F181 HydrophobicContact CD1-CD1 4.26Å; L149-F181 HydrophobicContact CD1-CG 4.44Å; L149-F181 HydrophobicContact CD2-CD1 3.69Å; L149-F181 HydrophobicContact CD2-CE1 3.71Å; L149-F181 HydrophobicContact CD2-CG 4.45Å; L149-F181 HydrophobicContact CG-CB 4.4Å; L149-F181 HydrophobicContact CG-CD1 3.51Å; L149-F181 HydrophobicContact CG-CE1 4.06Å; L149-F181 HydrophobicContact CG-CG 4.17Å; R179-F181 PolarHBondContact O-N 3.44Å; F181-K214 HydrophobicContact CE1-CG 4.47Å; F181-K214 HydrophobicContact CZ-CD 4.29Å; F181-K214 HydrophobicContact CZ-CG 4.14Å
182	Y	58.8	Low	65.2	Low	130 Å²	130	57.8 Å²	57.8	51%	0.51	31%	0.31	S	S	.	.			trans	-105.1	155.9	162.7	-64	-78	0	0	0	106.4	L180 P184 L185	L180-Y182 HydrophobicContact CB-CD2 4.38Å; L180-Y182 HydrophobicContact CB-CE2 3.78Å; L180-Y182 HydrophobicContact CD1-CE2 4.24Å; Y182-P184 CarbonylContact O-C 3.56Å; Y182-L185 PolarHBondContact O-N 3Å
183	Q	46.1	Very low	63.1	Low	162 Å²	162	59.9 Å²	59.9	76%	0.757	32%	0.324	S	S	*	.	S	Bend	trans	-80.2	128	160	-75	177.5	-16.6	0	0	107.4
184	P	52.9	Low	61.5	Low	120 Å²	120	65.1 Å²	65.1	78%	0.779	36%	0.355	S	S	*	.	S	Bend	cis	-80.1	148.7	4	33.2	-34.6	0	0	0	113.7	Y182	Y182-P184 CarbonylContact O-C 3.56Å
185	L	58.4	Low	60.5	Low	64 Å²	64	65.5 Å²	65.5	34%	0.335	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-55.5	139.3	-177	-61.6	171.4	0	0	0	111.6	Y182 H211 T213	Y182-L185 PolarHBondContact O-N 3Å; L185-H211 HydrophobicContact CB-CB 3.8Å; L185-H211 HydrophobicContact CD1-CB 3.78Å; L185-H211 HydrophobicContact CG-CB 4.4Å; L185-H211 PolarHBondContact O-CD2 3.03Å; L185-T213 HydrophobicContact CD1-CG2 4.34Å
186	K	54.6	Low	59.7	Low	114 Å²	114	68.9 Å²	68.9	50%	0.496	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-76.7	138.2	179.2	-70.1	-173.3	175.4	177.9	0	111.7
187	P	59.2	Low	59.9	Low	79 Å²	79	71.5 Å²	71.5	51%	0.513	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-57.7	145.6	172	-24.2	33.7	0	0	0	113	R210	P187-R210 CarbonylContact C-O 3.54Å; P187-R210 VanDerWaalsContact CA-O 3.32Å; P187-R210 WeakPolarHBondContact CA-O 3.32Å
188	L	59.9	Low	60.7	Low	31 Å²	31	72 Å²	72	16%	0.162	40%	0.397	C	S	.	.	S	Bend	trans	-72.2	-27	-179.9	-111.6	146.3	0	0	0	113.9	D190 L205 A209 R210 Y212	L188-D190 VanDerWaalsContact C-N 3.34Å; L188-D190 PolarHBondContact O-N 2.89Å; L188-L205 HydrophobicContact CD1-CD2 3.58Å; L188-L205 HydrophobicContact CD2-CD2 4.37Å; L188-A209 WeakPolarHBondContact CD1-O 3.3Å; L188-R210 WeakPolarHBondContact CB-O 3.49Å; L188-R210 PolarHBondContact N-O 3.17Å; L188-Y212 HydrophobicContact CD1-CD1 4.32Å; L188-Y212 HydrophobicContact CD1-CD2 4.42Å; L188-Y212 HydrophobicContact CD1-CE1 4.36Å; L188-Y212 HydrophobicContact CD1-CE2 4.35Å; L188-Y212 HydrophobicContact CD1-CG 4.45Å; L188-Y212 HydrophobicContact CD2-CD1 4.29Å; L188-Y212 HydrophobicContact CD2-CD2 4.03Å; L188-Y212 HydrophobicContact CD2-CE1 3.65Å; L188-Y212 HydrophobicContact CD2-CE2 3.21Å; L188-Y212 WeakPolarHBondContact CD2-OH 3.23Å; L188-Y212 HydrophobicContact CG-CD1 4.37Å; L188-Y212 HydrophobicContact CG-CD2 3.77Å; L188-Y212 HydrophobicContact CG-CE1 4.2Å; L188-Y212 HydrophobicContact CG-CE2 3.43Å; L188-Y212 VanDerWaalsContact CG-CE2 3.43Å; L188-Y212 HydrophobicContact CG-CG 4.26Å
189	A	52.8	Low	62	Low	92 Å²	92	75.1 Å²	75.1	76%	0.76	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.9	-161.9	0	0	0	0	0	115.6
190	D	53.6	Low	63.1	Low	130 Å²	130	75.3 Å²	75.3	70%	0.695	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-8.4	-164	-67.3	-30.7	0	0	0	115.6	L188	L188-D190 VanDerWaalsContact C-N 3.34Å; L188-D190 PolarHBondContact O-N 2.89Å
191	L	53.5	Low	64.2	Low	91 Å²	91	74.9 Å²	74.9	48%	0.476	40%	0.404	S	S	.	.	S	Bend	trans	-149.2	6.9	-151	-78.8	170.4	0	0	0	119.6	R179	R179-L191 PolarHBondContact NH2-O 2.94Å
192	D	56.3	Low	65.6	Low	48 Å²	48	73.9 Å²	73.9	26%	0.257	40%	0.399	S	S	.	.			trans	-111.8	129.4	-176.2	-69.1	-40.7	0	0	0	115.3	R151 R179 Y212	R151-D192 IonicContact CZ-OD1 3.96Å; R151-D192 IonicContact CZ-OD2 3.63Å; R151-D192 IonicContact NH1-OD1 3.3Å; R151-D192 PolarHBondContact NH1-OD1 3.35Å; R151-D192 IonicContact NH1-OD2 3.49Å; R151-D192 PolarHBondContact NH1-OD2 2.97Å; R151-D192 IonicContact NH2-OD1 3.67Å; R151-D192 PolarHBondContact NH2-OD1 3.39Å; R151-D192 IonicContact NH2-OD2 2.57Å; R179-D192 IonicContact NH2-OD1 2.73Å; D192-Y212 WeakPolarHBondContact OD2-CE2 3.34Å; D192-Y212 PolarHBondContact OD2-OH 3.47Å
193	P	53.7	Low	67.3	Low	44 Å²	44	67.7 Å²	67.7	29%	0.286	38%	0.375	S	S	.	.			trans	-50.2	152.4	166.2	-25.1	29	0	0	0	112.5	F177 V195	F177-P193 HydrophobicContact CD1-CG 4.35Å; F177-P193 HydrophobicContact CE1-CB 3.93Å; F177-P193 VanDerWaalsContact CE1-CD 3.47Å; F177-P193 HydrophobicContact CE1-CG 3.69Å; F177-P193 HydrophobicContact CZ-CB 4.13Å; F177-P193 HydrophobicContact CZ-CG 4.16Å; P193-V195 PolarHBondContact O-N 3.3Å
194	V	57.8	Low	69.7	Low	114 Å²	114	60.3 Å²	60.3	69%	0.691	34%	0.341	S	S	*	.			trans	-54.8	112	170.7	179.7	0	0	0	0	108.9	I242	V194-I242 HydrophobicContact CG1-CG2 3.97Å
195	V	63.2	Low	71.5	Confident	40 Å²	40	55.1 Å²	55.1	24%	0.242	31%	0.306	C	S	.	.			trans	-83.9	128.8	177.2	-180	0	0	0	0	108.4	F177 P193 F198	F177-V195 HydrophobicContact CE1-CG2 4.19Å; F177-V195 HydrophobicContact CZ-CG2 4.18Å; P193-V195 PolarHBondContact O-N 3.3Å; V195-F198 HydrophobicContact CB-CE1 4.12Å; V195-F198 HydrophobicContact CG1-CD1 4.41Å; V195-F198 HydrophobicContact CG1-CE1 4.24Å; V195-F198 WeakPolarHBondContact O-CZ 3.5Å
196	V	60.3	Low	73.1	Confident	72 Å²	72	52 Å²	52	44%	0.436	29%	0.29	S	S	.	.	S	Bend	trans	-90.5	-21.3	-171.9	-175.9	0	0	0	0	112.5	Q239 I242	V196-Q239 PolarHBondContact O-NE2 3.26Å; V196-I242 VanDerWaalsContact CA-CD1 3.43Å; V196-I242 HydrophobicContact CB-CD1 4.4Å; V196-I242 HydrophobicContact CG1-CD1 4.35Å; V196-I242 WeakPolarHBondContact O-CD1 3.47Å
197	T	72.8	Confident	75	Confident	58 Å²	58	46.6 Å²	46.6	36%	0.356	27%	0.266	S	S	.	.			trans	-139.8	123.8	-174.3	-49.8	0	0	0	0	111	W199	T197-W199 HydrophobicContact CG2-CB 4.25Å; T197-W199 HydrophobicContact CG2-CD2 3.39Å; T197-W199 HydrophobicContact CG2-CE3 3.87Å; T197-W199 HydrophobicContact CG2-CG 3.57Å; T197-W199 HydrophobicContact CG2-CZ2 4.16Å; T197-W199 HydrophobicContact CG2-CZ3 4.43Å
198	F	85.7	Confident	76.5	Confident	22 Å²	22	43.2 Å²	43.2	10%	0.096	25%	0.245	C	C	.	.			trans	-100.4	5.2	-174.1	-56.6	-64.3	0	0	0	114.6	V195 Y200 R201 L206 I242 H249 Q252	V195-F198 HydrophobicContact CB-CE1 4.12Å; V195-F198 HydrophobicContact CG1-CD1 4.41Å; V195-F198 HydrophobicContact CG1-CE1 4.24Å; V195-F198 WeakPolarHBondContact O-CZ 3.5Å; F198-Y200 PolarHBondContact O-N 3.39Å; F198-Y200 VanDerWaalsContact O-N 3.11Å; F198-R201 HydrophobicContact CB-CB 4.33Å; F198-R201 VanDerWaalsContact O-CB 3.25Å; F198-R201 WeakPolarHBondContact O-CB 3.28Å; F198-R201 PolarHBondContact O-N 3.27Å; F198-L206 HydrophobicContact CB-CD2 4.48Å; F198-I242 HydrophobicContact CE2-CD1 4.17Å; F198-I242 HydrophobicContact CE2-CG1 4.3Å; F198-I242 HydrophobicContact CZ-CG2 4.47Å; F198-H249 AromaticContact CD2-CD2 3.92Å; F198-H249 AromaticContact CD2-CG 3.97Å; F198-H249 AromaticContact CD2-NE2 3.99Å; F198-H249 AromaticContact CE1-CD2 3.98Å; F198-H249 AromaticContact CE1-NE2 3.47Å; F198-H249 WeakPolarHBondContact CE1-NE2 3.35Å; F198-H249 AromaticContact CE2-CD2 3.84Å; F198-H249 AromaticContact CE2-CE1 3.32Å; F198-H249 WeakPolarHBondContact CE2-CE1 3.4Å; F198-H249 AromaticContact CE2-CG 3.97Å; F198-H249 AromaticContact CE2-ND1 3.65Å; F198-H249 AromaticContact CE2-NE2 3.42Å; F198-H249 WeakPolarHBondContact CE2-NE2 3.42Å; F198-H249 AromaticContact CZ-CD2 3.87Å; F198-H249 AromaticContact CZ-CE1 3.37Å; F198-H249 WeakPolarHBondContact CZ-CE1 3.42Å; F198-H249 AromaticContact CZ-NE2 3.12Å; F198-H249 WeakPolarHBondContact CZ-NE2 3.42Å; F198-Q252 HydrophobicContact CB-CG 3.94Å
199	W	93.8	Very high	77.9	Confident	65 Å²	65	42.7 Å²	42.7	25%	0.246	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.3	-172	-53.4	-17.5	0	0	0	114.4	T197 P233 H236 C237	T197-W199 HydrophobicContact CG2-CB 4.25Å; T197-W199 HydrophobicContact CG2-CD2 3.39Å; T197-W199 HydrophobicContact CG2-CE3 3.87Å; T197-W199 HydrophobicContact CG2-CG 3.57Å; T197-W199 HydrophobicContact CG2-CZ2 4.16Å; T197-W199 HydrophobicContact CG2-CZ3 4.43Å; W199-P233 HydrophobicContact CD2-CB 4.49Å; W199-P233 HydrophobicContact CE3-CB 3.87Å; W199-P233 HydrophobicContact CE3-CG 3.89Å; W199-P233 HydrophobicContact CZ3-CB 4.35Å; W199-P233 HydrophobicContact CZ3-CG 3.86Å; W199-H236 AromaticContact CE2-CD2 3.95Å; W199-H236 AromaticContact CH2-CD2 3.56Å; W199-H236 AromaticContact CH2-NE2 3.85Å; W199-H236 AromaticContact CZ2-CD2 3.48Å; W199-H236 VanDerWaalsContact CZ2-CD2 3.48Å; W199-H236 WeakPolarHBondContact CZ2-CD2 3.29Å; W199-H236 AromaticContact CZ2-NE2 3.65Å; W199-C237 PolarHBondContact NE1-O 2.85Å
200	Y	95	Very high	79.2	Confident	27 Å²	27	46.8 Å²	46.8	11%	0.106	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	3.3	179.8	-49.5	-83.7	0	0	0	112.2	L153 K154 P155 F198 C223 I224 E227	L153-Y200 WeakPolarHBondContact O-CB 3.04Å; K154-Y200 HydrophobicContact CB-CD2 3.63Å; K154-Y200 HydrophobicContact CB-CE2 3.75Å; K154-Y200 HydrophobicContact CB-CG 4.11Å; P155-Y200 VanDerWaalsContact CD-CE1 3.42Å; P155-Y200 WeakPolarHBondContact CD-OH 3.06Å; P155-Y200 HydrophobicContact CG-CE1 4.01Å; P155-Y200 WeakPolarHBondContact CG-OH 3.3Å; F198-Y200 PolarHBondContact O-N 3.39Å; F198-Y200 VanDerWaalsContact O-N 3.11Å; Y200-C223 HydrophobicContact CD1-CB 3.64Å; Y200-C223 HydrophobicContact CE1-CB 4.29Å; Y200-I224 HydrophobicContact CD1-CG1 4.21Å; Y200-I224 HydrophobicContact CE1-CG1 4.25Å; Y200-E227 VanDerWaalsContact CE1-OE2 3.3Å; Y200-E227 WeakPolarHBondContact CE1-OE2 3.17Å; Y200-E227 PolarHBondContact OH-OE2 2.99Å
201	R	92.6	Very high	80.5	Confident	49 Å²	49	44.5 Å²	44.5	19%	0.185	23%	0.226	C	C	.	.			trans	-81.4	131.1	-176.1	-166.9	166.7	-174.1	-171.7	3.4	110.2	F198 L205 L206 W219	F198-R201 HydrophobicContact CB-CB 4.33Å; F198-R201 VanDerWaalsContact O-CB 3.25Å; F198-R201 WeakPolarHBondContact O-CB 3.28Å; F198-R201 PolarHBondContact O-N 3.27Å; R201-L205 HydrophobicContact CG-CB 3.79Å; R201-L205 HydrophobicContact CG-CD1 3.82Å; R201-L205 HydrophobicContact CG-CG 4.47Å; R201-L206 HydrophobicContact CB-CD2 4.36Å; R201-L206 HydrophobicContact CG-CD2 4.12Å; R201-L206 HydrophobicContact CG-CG 4.39Å; R201-W219 PolarHBondContact O-NE1 3.43Å
202	A	95.7	Very high	81.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.			trans	-67.2	146.9	-178.9	0	0	0	0	0	112.4	E204 L205 L206 I216 W219	A202-E204 HydrophobicContact CB-CG 4.4Å; A202-E204 VanDerWaalsContact CB-OE1 3.26Å; A202-E204 WeakPolarHBondContact CB-OE1 3.45Å; A202-E204 WeakPolarHBondContact CB-OE2 3.47Å; A202-E204 PolarHBondContact O-N 3.24Å; A202-L205 WeakPolarHBondContact O-CB 3.25Å; A202-L205 PolarHBondContact O-N 2.83Å; A202-L206 PolarHBondContact O-N 3.15Å; A202-I216 HydrophobicContact CB-CB 4.39Å; A202-I216 HydrophobicContact CB-CG2 4.46Å; A202-W219 VanDerWaalsContact CA-CD1 3.41Å; A202-W219 HydrophobicContact CB-CB 3.77Å; A202-W219 HydrophobicContact CB-CD2 4.27Å; A202-W219 HydrophobicContact CB-CG 3.68Å
203	P	96	Very high	83.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-31.7	-175	25.1	-35	0	0	0	112.6	L205 L206 L207 W219 I256 W268	P203-L205 VanDerWaalsContact C-N 3.28Å; P203-L205 PolarHBondContact O-N 3.21Å; P203-L206 CarbonylContact O-C 3.36Å; P203-L206 PolarHBondContact O-N 3.07Å; P203-L206 VanDerWaalsContact O-N 3.16Å; P203-L207 WeakPolarHBondContact O-CG 3.21Å; P203-L207 PolarHBondContact O-N 3.3Å; P203-W219 HydrophobicContact CG-CE3 4.32Å; P203-W219 HydrophobicContact CG-CH2 3.96Å; P203-W219 HydrophobicContact CG-CZ2 4.3Å; P203-W219 HydrophobicContact CG-CZ3 3.96Å; P203-I256 HydrophobicContact CB-CD1 4.41Å; P203-W268 HydrophobicContact CB-CH2 4.13Å; P203-W268 HydrophobicContact CB-CZ3 4.07Å; P203-W268 HydrophobicContact CG-CH2 4.24Å; P203-W268 HydrophobicContact CG-CZ3 4.18Å
204	E	95.1	Very high	85.4	Confident	7 Å²	7	42.8 Å²	42.8	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-63.5	-33.9	175.5	65	-85.3	-162.4	0	0	112.5	A202 L207 G208 A209 W268 M274 P322 R325	A202-E204 HydrophobicContact CB-CG 4.4Å; A202-E204 VanDerWaalsContact CB-OE1 3.26Å; A202-E204 WeakPolarHBondContact CB-OE1 3.45Å; A202-E204 WeakPolarHBondContact CB-OE2 3.47Å; A202-E204 PolarHBondContact O-N 3.24Å; E204-L207 CarbonylContact O-C 3.51Å; E204-L207 PolarHBondContact O-N 2.88Å; E204-G208 PolarHBondContact O-N 2.95Å; E204-A209 HydrophobicContact CB-CB 4.27Å; E204-A209 HydrophobicContact CG-CB 4.41Å; E204-A209 WeakPolarHBondContact O-CB 3.47Å; E204-A209 PolarHBondContact O-N 3.13Å; E204-W268 HydrophobicContact CB-CH2 4.16Å; E204-W268 HydrophobicContact CB-CZ2 3.97Å; E204-M274 HydrophobicContact CB-CE 3.9Å; E204-M274 WeakPolarHBondContact O-CE 3.34Å; E204-P322 HydrophobicContact CB-CG 4.28Å; E204-P322 HydrophobicContact CG-CB 4.32Å; E204-P322 HydrophobicContact CG-CG 4.15Å; E204-R325 IonicContact OE1-CZ 2.82Å; E204-R325 IonicContact OE1-NH1 3.6Å; E204-R325 PolarHBondContact OE1-NH1 2.94Å; E204-R325 IonicContact OE1-NH2 2.7Å; E204-R325 PolarHBondContact OE1-NH2 3.28Å; E204-R325 IonicContact OE2-CZ 2.95Å; E204-R325 IonicContact OE2-NH1 2.65Å; E204-R325 IonicContact OE2-NH2 3.5Å; E204-R325 PolarHBondContact OE2-NH2 3.35Å
205	L	91.8	Very high	87.2	Confident	10 Å²	10	37.9 Å²	37.9	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-71.1	-35.3	174.7	-66.4	174.8	0	0	0	111.4	L188 R201 A202 P203 L207 G208 A209 Y212 I216	L188-L205 HydrophobicContact CD1-CD2 3.58Å; L188-L205 HydrophobicContact CD2-CD2 4.37Å; R201-L205 HydrophobicContact CG-CB 3.79Å; R201-L205 HydrophobicContact CG-CD1 3.82Å; R201-L205 HydrophobicContact CG-CG 4.47Å; A202-L205 WeakPolarHBondContact O-CB 3.25Å; A202-L205 PolarHBondContact O-N 2.83Å; P203-L205 VanDerWaalsContact C-N 3.28Å; P203-L205 PolarHBondContact O-N 3.21Å; L205-L207 PolarHBondContact O-N 3.49Å; L205-G208 PolarHBondContact O-N 3.49Å; L205-A209 HydrophobicContact CD2-CB 4.37Å; L205-Y212 HydrophobicContact CD1-CD1 4.37Å; L205-Y212 HydrophobicContact CD1-CE1 4.03Å; L205-Y212 HydrophobicContact CD2-CD1 3.83Å; L205-Y212 HydrophobicContact CD2-CE1 3.77Å; L205-I216 HydrophobicContact CD1-CB 4.16Å; L205-I216 HydrophobicContact CD1-CG2 3.99Å; L205-I216 HydrophobicContact CD2-CG2 4.4Å; L205-I216 HydrophobicContact CG-CG2 4.13Å
206	L	92.4	Very high	88.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-72.2	-17.3	174.6	-58.5	175.2	0	0	0	112.7	F198 R201 A202 P203 P247 Y248 H249 Q252 L253 I256	F198-L206 HydrophobicContact CB-CD2 4.48Å; R201-L206 HydrophobicContact CB-CD2 4.36Å; R201-L206 HydrophobicContact CG-CD2 4.12Å; R201-L206 HydrophobicContact CG-CG 4.39Å; A202-L206 PolarHBondContact O-N 3.15Å; P203-L206 CarbonylContact O-C 3.36Å; P203-L206 PolarHBondContact O-N 3.07Å; P203-L206 VanDerWaalsContact O-N 3.16Å; L206-P247 WeakPolarHBondContact CA-O 3.28Å; L206-Y248 WeakPolarHBondContact O-CA 3.33Å; L206-H249 HydrophobicContact CD2-CB 4.25Å; L206-Q252 HydrophobicContact CD1-CB 4.21Å; L206-Q252 HydrophobicContact CD1-CG 3.58Å; L206-Q252 HydrophobicContact CD2-CG 4.29Å; L206-L253 HydrophobicContact CB-CD1 4.28Å; L206-L253 HydrophobicContact CB-CD2 3.77Å; L206-L253 HydrophobicContact CB-CG 3.89Å; L206-L253 HydrophobicContact CD1-CD2 4.07Å; L206-L253 HydrophobicContact CD1-CG 4.17Å; L206-I256 HydrophobicContact CD1-CD1 3.57Å
207	L	93.7	Very high	90.4	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	16.3	174	-67	174	0	0	0	112.8	P203 E204 L205 Y248 L253 W268 M271 M274 P275 D276 L280	P203-L207 WeakPolarHBondContact O-CG 3.21Å; P203-L207 PolarHBondContact O-N 3.3Å; E204-L207 CarbonylContact O-C 3.51Å; E204-L207 PolarHBondContact O-N 2.88Å; L205-L207 PolarHBondContact O-N 3.49Å; L207-Y248 HydrophobicContact CD2-CE2 4.26Å; L207-L253 HydrophobicContact CD2-CD1 3.87Å; L207-L253 HydrophobicContact CD2-CD2 4.33Å; L207-L253 HydrophobicContact CG-CD2 4.23Å; L207-W268 HydrophobicContact CD1-CH2 3.68Å; L207-W268 HydrophobicContact CD1-CZ2 4.48Å; L207-W268 HydrophobicContact CD1-CZ3 3.97Å; L207-M271 HydrophobicContact CD1-CG 4.22Å; L207-M274 HydrophobicContact CB-CB 3.82Å; L207-M274 HydrophobicContact CB-CE 3.85Å; L207-M274 HydrophobicContact CB-CG 4.13Å; L207-M274 HydrophobicContact CD1-CG 4.32Å; L207-P275 WeakPolarHBondContact O-CD 3.28Å; L207-D276 PolarHBondContact O-N 2.88Å; L207-D276 VanDerWaalsContact O-N 3.08Å; L207-L280 HydrophobicContact CD1-CD1 4.46Å; L207-L280 HydrophobicContact CD2-CB 4.14Å; L207-L280 HydrophobicContact CD2-CD1 3.68Å
208	G	89.6	Confident	91.6	Very high	7 Å²	7	30.3 Å²	30.3	7%	0.072	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	23.9	170.8	0	0	0	0	0	114.6	E204 L205 R210 P275 D276	E204-G208 PolarHBondContact O-N 2.95Å; L205-G208 PolarHBondContact O-N 3.49Å; G208-R210 PolarHBondContact O-N 2.93Å; G208-P275 VanDerWaalsContact O-CG 3.27Å; G208-P275 WeakPolarHBondContact O-CG 3.26Å; G208-D276 WeakPolarHBondContact CA-OD2 3.42Å
209	A	89.5	Confident	92.2	Very high	21 Å²	21	29.2 Å²	29.2	17%	0.174	13%	0.132	C	C	.	.			trans	-43.8	139.1	167.3	0	0	0	0	0	109.7	L188 E204 L205 M274	L188-A209 WeakPolarHBondContact CD1-O 3.3Å; E204-A209 HydrophobicContact CB-CB 4.27Å; E204-A209 HydrophobicContact CG-CB 4.41Å; E204-A209 WeakPolarHBondContact O-CB 3.47Å; E204-A209 PolarHBondContact O-N 3.13Å; L205-A209 HydrophobicContact CD2-CB 4.37Å; A209-M274 HydrophobicContact CB-CE 3.83Å
210	R	81.6	Confident	92.4	Very high	178 Å²	178	26.4 Å²	26.4	67%	0.672	12%	0.122	S	C	*	.	S	Bend	trans	-99.3	-3.9	-178.5	-65.1	-173.8	179.9	-175.7	0.1	113.9	P187 L188 G208	P187-R210 CarbonylContact C-O 3.54Å; P187-R210 VanDerWaalsContact CA-O 3.32Å; P187-R210 WeakPolarHBondContact CA-O 3.32Å; L188-R210 WeakPolarHBondContact CB-O 3.49Å; L188-R210 PolarHBondContact N-O 3.17Å; G208-R210 PolarHBondContact O-N 2.93Å
211	H	80.6	Confident	92.6	Very high	81 Å²	81	25.1 Å²	25.1	38%	0.375	12%	0.117	S	C	.	.	B	Isolated β-bridge	trans	-131.8	138.8	-179.3	-54.5	101	0	0	0	110.7	L185	L185-H211 HydrophobicContact CB-CB 3.8Å; L185-H211 HydrophobicContact CD1-CB 3.78Å; L185-H211 HydrophobicContact CG-CB 4.4Å; L185-H211 PolarHBondContact O-CD2 3.03Å
212	Y	81.4	Confident	92.9	Very high	30 Å²	30	22.8 Å²	22.8	12%	0.118	11%	0.108	C	C	.	.			trans	-78.5	142	166.2	-69.7	-64.9	0	0	0	110.4	R151 L188 D192 L205 I216	R151-Y212 VanDerWaalsContact CD-CD2 3.5Å; R151-Y212 HydrophobicContact CG-CD1 4.4Å; R151-Y212 HydrophobicContact CG-CG 4.36Å; L188-Y212 HydrophobicContact CD1-CD1 4.32Å; L188-Y212 HydrophobicContact CD1-CD2 4.42Å; L188-Y212 HydrophobicContact CD1-CE1 4.36Å; L188-Y212 HydrophobicContact CD1-CE2 4.35Å; L188-Y212 HydrophobicContact CD1-CG 4.45Å; L188-Y212 HydrophobicContact CD2-CD1 4.29Å; L188-Y212 HydrophobicContact CD2-CD2 4.03Å; L188-Y212 HydrophobicContact CD2-CE1 3.65Å; L188-Y212 HydrophobicContact CD2-CE2 3.21Å; L188-Y212 WeakPolarHBondContact CD2-OH 3.23Å; L188-Y212 HydrophobicContact CG-CD1 4.37Å; L188-Y212 HydrophobicContact CG-CD2 3.77Å; L188-Y212 HydrophobicContact CG-CE1 4.2Å; L188-Y212 HydrophobicContact CG-CE2 3.43Å; L188-Y212 VanDerWaalsContact CG-CE2 3.43Å; L188-Y212 HydrophobicContact CG-CG 4.26Å; D192-Y212 WeakPolarHBondContact OD2-CE2 3.34Å; D192-Y212 PolarHBondContact OD2-OH 3.47Å; L205-Y212 HydrophobicContact CD1-CD1 4.37Å; L205-Y212 HydrophobicContact CD1-CE1 4.03Å; L205-Y212 HydrophobicContact CD2-CD1 3.83Å; L205-Y212 HydrophobicContact CD2-CE1 3.77Å; Y212-I216 HydrophobicContact CD1-CD1 3.25Å; Y212-I216 HydrophobicContact CE1-CD1 4.06Å; Y212-I216 HydrophobicContact CG-CD1 3.92Å
213	T	89.9	Confident	93	Very high	44 Å²	44	22.8 Å²	22.8	27%	0.27	11%	0.108	S	C	.	.			trans	-132.8	165.4	179.6	66.1	0	0	0	0	109.6	L185 A215 I216	L185-T213 HydrophobicContact CD1-CG2 4.34Å; T213-A215 PolarHBondContact O-N 3.13Å; T213-A215 PolarHBondContact OG1-N 3.2Å; T213-I216 WeakPolarHBondContact O-CD1 3.48Å; T213-I216 WeakPolarHBondContact O-CG1 3.36Å; T213-I216 PolarHBondContact O-N 3.43Å
214	K	94.2	Very high	93.2	Very high	73 Å²	73	22.8 Å²	22.8	32%	0.317	11%	0.108	S	C	.	.	H	α-helix	trans	-53.5	-35.6	171.1	-67.8	-176.4	178.2	-168.8	0	112.1	H144 L149 F181 I216 D217 I218	H144-K214 HydrophobicContact CB-CD 3.87Å; H144-K214 HydrophobicContact CB-CG 4.25Å; H144-K214 PolarHBondContact CE1-O 3.41Å; H144-K214 WeakPolarHBondContact O-CE 3.27Å; H144-K214 PolarHBondContact O-NZ 3.08Å; L149-K214 HydrophobicContact CD2-CB 4.37Å; L149-K214 HydrophobicContact CD2-CG 3.89Å; F181-K214 HydrophobicContact CE1-CG 4.47Å; F181-K214 HydrophobicContact CZ-CD 4.29Å; F181-K214 HydrophobicContact CZ-CG 4.14Å; K214-I216 PolarHBondContact O-N 2.8Å; K214-D217 PolarHBondContact O-N 3.04Å; K214-D217 VanDerWaalsContact O-N 3.14Å; K214-I218 PolarHBondContact O-N 3.43Å
215	A	95.9	Very high	93.3	Very high	11 Å²	11	22.5 Å²	22.5	9%	0.091	11%	0.107	C	C	.	.	H	α-helix	trans	-61.2	-27.8	-175.4	0	0	0	0	0	113.6	T213 D217 I218 W219 P322 R325	T213-A215 PolarHBondContact O-N 3.13Å; T213-A215 PolarHBondContact OG1-N 3.2Å; A215-D217 VanDerWaalsContact C-N 3.32Å; A215-D217 PolarHBondContact O-N 3.49Å; A215-I218 PolarHBondContact O-N 3.18Å; A215-W219 PolarHBondContact O-N 2.83Å; A215-P322 HydrophobicContact CB-CB 3.85Å; A215-P322 WeakPolarHBondContact CB-O 3.49Å; A215-R325 VanDerWaalsContact C-NH1 3.26Å; A215-R325 HydrophobicContact CB-CB 4.44Å; A215-R325 VanDerWaalsContact O-CD 3.32Å; A215-R325 WeakPolarHBondContact O-CD 3.28Å; A215-R325 PolarHBondContact O-NH1 3.02Å
216	I	94.6	Very high	93.7	Very high	8 Å²	8	22 Å²	22	4%	0.041	11%	0.105	C	C	.	.	H	α-helix	trans	-64.9	-39.1	178.3	76.7	-164.7	0	0	0	111.3	R151 A202 L205 Y212 T213 K214 I218 W219 A220	R151-I216 HydrophobicContact CB-CD1 4.41Å; R151-I216 HydrophobicContact CG-CD1 4.01Å; A202-I216 HydrophobicContact CB-CB 4.39Å; A202-I216 HydrophobicContact CB-CG2 4.46Å; L205-I216 HydrophobicContact CD1-CB 4.16Å; L205-I216 HydrophobicContact CD1-CG2 3.99Å; L205-I216 HydrophobicContact CD2-CG2 4.4Å; L205-I216 HydrophobicContact CG-CG2 4.13Å; Y212-I216 HydrophobicContact CD1-CD1 3.25Å; Y212-I216 HydrophobicContact CE1-CD1 4.06Å; Y212-I216 HydrophobicContact CG-CD1 3.92Å; T213-I216 WeakPolarHBondContact O-CD1 3.48Å; T213-I216 WeakPolarHBondContact O-CG1 3.36Å; T213-I216 PolarHBondContact O-N 3.43Å; K214-I216 PolarHBondContact O-N 2.8Å; I216-I218 VanDerWaalsContact C-N 3.32Å; I216-W219 PolarHBondContact O-N 2.65Å; I216-A220 PolarHBondContact O-N 3.5Å; I216-A220 VanDerWaalsContact O-N 3.15Å
217	D	96.6	Very high	93.9	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.011	11%	0.106	C	C	.	.	H	α-helix	trans	-69.6	-38.7	179.7	-72.5	-22.2	0	0	0	108.6	I140 H144 H150 R151 L153 K214 A215 W219 A220 I221	I140-D217 HydrophobicContact CG2-CB 4.38Å; H144-D217 IonicContact CD2-OD2 2.86Å; H144-D217 IonicContact CE1-OD2 2.82Å; H144-D217 IonicContact NE2-OD2 3.98Å; H144-D217 PolarHBondContact NE2-OD2 3.28Å; H150-D217 PolarHBondContact N-OD2 3.26Å; R151-D217 PolarHBondContact N-OD1 3.4Å; L153-D217 HydrophobicContact CD1-CB 3.73Å; K214-D217 PolarHBondContact O-N 3.04Å; K214-D217 VanDerWaalsContact O-N 3.14Å; A215-D217 VanDerWaalsContact C-N 3.32Å; A215-D217 PolarHBondContact O-N 3.49Å; D217-W219 PolarHBondContact O-N 2.81Å; D217-A220 WeakPolarHBondContact O-CB 3.36Å; D217-A220 PolarHBondContact O-N 3.33Å; D217-I221 VanDerWaalsContact O-CG1 3.26Å; D217-I221 WeakPolarHBondContact O-CG1 3.43Å; D217-I221 PolarHBondContact O-N 3.22Å
218	I	98.5	Very high	94.1	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-64.6	-39.7	176.7	-53.6	-57.3	0	0	0	111.9	I140 K214 A215 I216 A220 I221 G222 L317 R325 L326 A328	I140-I218 HydrophobicContact CG2-CD1 4.38Å; K214-I218 PolarHBondContact O-N 3.43Å; A215-I218 PolarHBondContact O-N 3.18Å; I216-I218 VanDerWaalsContact C-N 3.32Å; I218-A220 VanDerWaalsContact C-N 3.35Å; I218-A220 PolarHBondContact O-N 3.14Å; I218-I221 HydrophobicContact CD1-CD1 4.09Å; I218-I221 WeakPolarHBondContact O-CB 3.19Å; I218-I221 PolarHBondContact O-N 3.44Å; I218-G222 PolarHBondContact O-N 3.3Å; I218-L317 HydrophobicContact CG2-CD2 3.53Å; I218-R325 HydrophobicContact CB-CG 4.42Å; I218-R325 HydrophobicContact CG2-CG 4.04Å; I218-L326 WeakPolarHBondContact CG1-O 2.9Å; I218-L326 WeakPolarHBondContact CG2-O 3.39Å; I218-A328 HydrophobicContact CD1-CB 3.85Å
219	W	98.5	Very high	94.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.9	-46.5	173.2	176.1	-84.9	0	0	0	111.4	R201 A202 P203 A215 I216 D217 I221 G222 C223 F235 I256 L318 M320	R201-W219 PolarHBondContact O-NE1 3.43Å; A202-W219 VanDerWaalsContact CA-CD1 3.41Å; A202-W219 HydrophobicContact CB-CB 3.77Å; A202-W219 HydrophobicContact CB-CD2 4.27Å; A202-W219 HydrophobicContact CB-CG 3.68Å; P203-W219 HydrophobicContact CG-CE3 4.32Å; P203-W219 HydrophobicContact CG-CH2 3.96Å; P203-W219 HydrophobicContact CG-CZ2 4.3Å; P203-W219 HydrophobicContact CG-CZ3 3.96Å; A215-W219 PolarHBondContact O-N 2.83Å; I216-W219 PolarHBondContact O-N 2.65Å; D217-W219 PolarHBondContact O-N 2.81Å; W219-I221 VanDerWaalsContact C-N 3.29Å; W219-I221 PolarHBondContact O-N 3.11Å; W219-G222 PolarHBondContact O-N 2.95Å; W219-G222 VanDerWaalsContact O-N 3.11Å; W219-C223 PolarHBondContact NE1-SG 3.25Å; W219-C223 VanDerWaalsContact NE1-SG 3.4Å; W219-C223 PolarHBondContact O-N 3.25Å; W219-C223 PolarHBondContact O-SG 2.77Å; W219-F235 AromaticContact CE2-CE2 3.83Å; W219-F235 HydrophobicContact CH2-CE2 4.13Å; W219-F235 HydrophobicContact CH2-CZ 4.07Å; W219-F235 HydrophobicContact CZ2-CD2 4.07Å; W219-F235 AromaticContact CZ2-CE2 3.34Å; W219-F235 HydrophobicContact CZ2-CE2 3.34Å; W219-F235 AromaticContact CZ2-CZ 3.7Å; W219-F235 HydrophobicContact CZ2-CZ 3.7Å; W219-I256 HydrophobicContact CH2-CG2 4.08Å; W219-I256 HydrophobicContact CZ2-CD1 4.15Å; W219-I256 HydrophobicContact CZ2-CG1 4.34Å; W219-I256 HydrophobicContact CZ2-CG2 4.21Å; W219-L318 HydrophobicContact CD2-CD2 4.06Å; W219-L318 HydrophobicContact CE3-CD2 4.13Å; W219-L318 HydrophobicContact CH2-CD2 4.5Å; W219-L318 HydrophobicContact CZ2-CD2 4.43Å; W219-L318 HydrophobicContact CZ3-CB 4.38Å; W219-L318 HydrophobicContact CZ3-CD2 4.36Å; W219-L318 WeakPolarHBondContact CZ3-O 3.14Å; W219-M320 HydrophobicContact CH2-CG 4.43Å; W219-M320 HydrophobicContact CZ3-CG 4.32Å
220	A	98	Very high	94.6	Very high	5 Å²	5	22.2 Å²	22.2	4%	0.041	10%	0.101	C	C	.	.	H	α-helix	trans	-60.8	-38.7	177.1	0	0	0	0	0	112	L153 I216 D217 I218 C223 I224	L153-A220 HydrophobicContact CB-CB 3.73Å; I216-A220 PolarHBondContact O-N 3.5Å; I216-A220 VanDerWaalsContact O-N 3.15Å; D217-A220 WeakPolarHBondContact O-CB 3.36Å; D217-A220 PolarHBondContact O-N 3.33Å; I218-A220 VanDerWaalsContact C-N 3.35Å; I218-A220 PolarHBondContact O-N 3.14Å; A220-C223 WeakPolarHBondContact O-CB 3.49Å; A220-C223 PolarHBondContact O-N 3.27Å; A220-I224 WeakPolarHBondContact O-CG1 3.37Å; A220-I224 PolarHBondContact O-N 3.46Å
221	I	98.7	Very high	95.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.8	-42	172.9	-66.6	166.2	0	0	0	111.3	M133 I136 L137 I140 L153 D217 I218 W219 C223 I224 F225	M133-I221 HydrophobicContact CE-CG2 3.48Å; M133-I221 VanDerWaalsContact CE-CG2 3.48Å; I136-I221 HydrophobicContact CG2-CD1 4.23Å; I136-I221 HydrophobicContact CG2-CG1 3.94Å; I136-I221 HydrophobicContact CG2-CG2 4.34Å; L137-I221 HydrophobicContact CD2-CD1 4.07Å; L137-I221 HydrophobicContact CD2-CG2 3.97Å; L137-I221 HydrophobicContact CG-CG2 4.41Å; I140-I221 HydrophobicContact CB-CD1 4Å; I140-I221 HydrophobicContact CG1-CD1 3.75Å; I140-I221 HydrophobicContact CG2-CD1 4Å; L153-I221 HydrophobicContact CD1-CD1 4.22Å; L153-I221 HydrophobicContact CD1-CG1 3.9Å; D217-I221 VanDerWaalsContact O-CG1 3.26Å; D217-I221 WeakPolarHBondContact O-CG1 3.43Å; D217-I221 PolarHBondContact O-N 3.22Å; I218-I221 HydrophobicContact CD1-CD1 4.09Å; I218-I221 WeakPolarHBondContact O-CB 3.19Å; I218-I221 PolarHBondContact O-N 3.44Å; W219-I221 VanDerWaalsContact C-N 3.29Å; W219-I221 PolarHBondContact O-N 3.11Å; I221-C223 VanDerWaalsContact C-N 3.3Å; I221-C223 PolarHBondContact O-N 3.27Å; I221-I224 PolarHBondContact O-N 3.33Å; I221-F225 WeakPolarHBondContact O-CB 3.36Å; I221-F225 PolarHBondContact O-N 2.99Å
222	G	98.7	Very high	95.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.4	-40	173.1	0	0	0	0	0	112.6	I218 W219 F225 A226 L314	I218-G222 PolarHBondContact O-N 3.3Å; W219-G222 PolarHBondContact O-N 2.95Å; W219-G222 VanDerWaalsContact O-N 3.11Å; G222-F225 PolarHBondContact O-N 2.94Å; G222-A226 PolarHBondContact O-N 3.42Å; G222-L314 WeakPolarHBondContact O-CD1 3.47Å
223	C	98.7	Very high	96.6	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-63.7	-45.3	174.9	-61.2	0	0	0	0	111.8	Y200 W219 A220 I221 F225 A226 E227 I234 F235	Y200-C223 HydrophobicContact CD1-CB 3.64Å; Y200-C223 HydrophobicContact CE1-CB 4.29Å; W219-C223 PolarHBondContact NE1-SG 3.25Å; W219-C223 VanDerWaalsContact NE1-SG 3.4Å; W219-C223 PolarHBondContact O-N 3.25Å; W219-C223 PolarHBondContact O-SG 2.77Å; A220-C223 WeakPolarHBondContact O-CB 3.49Å; A220-C223 PolarHBondContact O-N 3.27Å; I221-C223 VanDerWaalsContact C-N 3.3Å; I221-C223 PolarHBondContact O-N 3.27Å; C223-F225 VanDerWaalsContact C-N 3.31Å; C223-F225 PolarHBondContact O-N 2.65Å; C223-A226 PolarHBondContact O-N 2.83Å; C223-E227 WeakPolarHBondContact O-CB 3.38Å; C223-E227 PolarHBondContact O-N 2.9Å; C223-I234 HydrophobicContact CB-CG2 4.26Å; C223-F235 VanDerWaalsContact SG-CD2 3.55Å; C223-F235 WeakPolarHBondContact SG-CE2 3.43Å
224	I	98.7	Very high	97	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.3	-40.6	175.5	-68	163.4	0	0	0	110.4	L105 I136 L153 P155 I158 Y200 A220 I221 E227 L228	L105-I224 HydrophobicContact CD1-CG2 3.77Å; I136-I224 HydrophobicContact CD1-CG2 4.29Å; L153-I224 HydrophobicContact CB-CD1 4.37Å; P155-I224 HydrophobicContact CG-CG1 4.32Å; I158-I224 HydrophobicContact CG1-CD1 4.12Å; Y200-I224 HydrophobicContact CD1-CG1 4.21Å; Y200-I224 HydrophobicContact CE1-CG1 4.25Å; A220-I224 WeakPolarHBondContact O-CG1 3.37Å; A220-I224 PolarHBondContact O-N 3.46Å; I221-I224 PolarHBondContact O-N 3.33Å; I224-E227 PolarHBondContact O-N 3.32Å; I224-L228 HydrophobicContact CG2-CD1 4.07Å; I224-L228 HydrophobicContact CG2-CG 4.35Å; I224-L228 WeakPolarHBondContact O-CG 3.42Å; I224-L228 PolarHBondContact O-N 3.22Å
225	F	98.7	Very high	97.1	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-62.7	-48.9	178.6	-171	-158.1	0	0	0	111.6	V129 M133 I221 G222 C223 E227 L228 L229 E310 L313 L314 L317 Y336	V129-F225 HydrophobicContact CG1-CD2 4.03Å; V129-F225 HydrophobicContact CG1-CE2 3.74Å; M133-F225 HydrophobicContact CE-CB 3.55Å; M133-F225 HydrophobicContact CE-CD1 4.29Å; M133-F225 HydrophobicContact CE-CD2 4.23Å; M133-F225 HydrophobicContact CE-CG 3.78Å; M133-F225 HydrophobicContact CG-CB 4.47Å; M133-F225 HydrophobicContact CG-CD2 3.47Å; M133-F225 VanDerWaalsContact CG-CD2 3.47Å; M133-F225 HydrophobicContact CG-CE2 3.84Å; M133-F225 HydrophobicContact CG-CG 4.01Å; M133-F225 HydrophobicContact SD-CB 3.58Å; M133-F225 VanDerWaalsContact SD-CB 3.58Å; M133-F225 HydrophobicContact SD-CD2 3.69Å; M133-F225 HydrophobicContact SD-CG 3.78Å; I221-F225 WeakPolarHBondContact O-CB 3.36Å; I221-F225 PolarHBondContact O-N 2.99Å; G222-F225 PolarHBondContact O-N 2.94Å; C223-F225 VanDerWaalsContact C-N 3.31Å; C223-F225 PolarHBondContact O-N 2.65Å; F225-E227 VanDerWaalsContact C-N 3.25Å; F225-E227 PolarHBondContact O-N 3.33Å; F225-L228 PolarHBondContact O-N 2.57Å; F225-L229 HydrophobicContact CD2-CD1 4.08Å; F225-L229 HydrophobicContact CD2-CG 4.05Å; F225-L229 HydrophobicContact CE2-CD1 3.86Å; F225-L229 HydrophobicContact CE2-CD2 3.94Å; F225-L229 HydrophobicContact CE2-CG 3.9Å; F225-L229 HydrophobicContact CZ-CD1 4.1Å; F225-L229 WeakPolarHBondContact O-CG 3.42Å; F225-L229 PolarHBondContact O-N 2.92Å; F225-E310 HydrophobicContact CZ-CB 4.13Å; F225-E310 HydrophobicContact CZ-CG 4.26Å; F225-L313 HydrophobicContact CE1-CB 4.16Å; F225-L313 HydrophobicContact CE1-CD2 3.86Å; F225-L313 HydrophobicContact CE1-CG 4.01Å; F225-L313 HydrophobicContact CZ-CD2 4.41Å; F225-L314 HydrophobicContact CB-CD1 4.15Å; F225-L314 HydrophobicContact CD1-CB 4.03Å; F225-L314 HydrophobicContact CD1-CD1 3.94Å; F225-L314 HydrophobicContact CE1-CB 4.14Å; F225-L314 HydrophobicContact CG-CD1 4.37Å; F225-L317 HydrophobicContact CD1-CD1 3.98Å; F225-Y336 HydrophobicContact CE2-CE1 4.31Å; F225-Y336 HydrophobicContact CZ-CD1 4.47Å; F225-Y336 AromaticContact CZ-CE1 3.89Å; F225-Y336 HydrophobicContact CZ-CE1 3.89Å; F225-Y336 AromaticContact CZ-CZ 3.94Å
226	A	98.2	Very high	97	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.008	6%	0.062	C	C	.	.	H	α-helix	trans	-59.7	-37.5	175.6	0	0	0	0	0	112.4	G222 C223 L229 T230 I234 L314	G222-A226 PolarHBondContact O-N 3.42Å; C223-A226 PolarHBondContact O-N 2.83Å; A226-L229 PolarHBondContact O-N 2.91Å; A226-T230 WeakPolarHBondContact O-CG2 3.21Å; A226-T230 PolarHBondContact O-N 3.04Å; A226-T230 PolarHBondContact O-OG1 3.49Å; A226-I234 HydrophobicContact CB-CB 3.75Å; A226-I234 HydrophobicContact CB-CD1 3.64Å; A226-I234 HydrophobicContact CB-CG1 4.25Å; A226-I234 HydrophobicContact CB-CG2 3.87Å; A226-L314 HydrophobicContact CB-CD1 4Å; A226-L314 HydrophobicContact CB-CD2 4.03Å
227	E	98	Very high	96.6	Very high	6 Å²	6	13.4 Å²	13.4	3%	0.028	7%	0.065	C	C	.	.	H	α-helix	trans	-70.3	-36.2	177.2	-169.5	174.6	175.4	0	0	112.3	I109 P155 Y200 C223 I224 F225 L229 Y231	I109-E227 HydrophobicContact CD1-CB 4.41Å; I109-E227 HydrophobicContact CD1-CG 3.81Å; I109-E227 HydrophobicContact CG1-CG 4.49Å; I109-E227 HydrophobicContact CG2-CG 3.97Å; P155-E227 WeakPolarHBondContact CG-OE2 3.47Å; Y200-E227 VanDerWaalsContact CE1-OE2 3.3Å; Y200-E227 WeakPolarHBondContact CE1-OE2 3.17Å; Y200-E227 PolarHBondContact OH-OE2 2.99Å; C223-E227 WeakPolarHBondContact O-CB 3.38Å; C223-E227 PolarHBondContact O-N 2.9Å; I224-E227 PolarHBondContact O-N 3.32Å; F225-E227 VanDerWaalsContact C-N 3.25Å; F225-E227 PolarHBondContact O-N 3.33Å; E227-L229 VanDerWaalsContact C-N 3.33Å; E227-L229 PolarHBondContact O-N 3.42Å; E227-Y231 WeakPolarHBondContact O-CA 3.41Å; E227-Y231 PolarHBondContact O-N 2.87Å
228	L	97.7	Very high	95.7	Very high	6 Å²	6	23.3 Å²	23.3	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-64.6	-36.5	172.2	-75.9	171.1	0	0	0	112.3	L105 I109 V129 L132 M133 I224 F225 Y231	L105-L228 HydrophobicContact CD1-CD1 4.16Å; L105-L228 HydrophobicContact CD1-CD2 4.24Å; L105-L228 HydrophobicContact CD1-CG 4.47Å; L105-L228 HydrophobicContact CD2-CD2 4.07Å; I109-L228 HydrophobicContact CD1-CD2 4.06Å; I109-L228 HydrophobicContact CD1-CG 4.44Å; I109-L228 HydrophobicContact CG1-CD2 4.02Å; V129-L228 HydrophobicContact CG1-CB 4.01Å; V129-L228 HydrophobicContact CG1-CD1 4.47Å; V129-L228 HydrophobicContact CG2-CB 4.39Å; L132-L228 HydrophobicContact CB-CD1 4.31Å; L132-L228 HydrophobicContact CD1-CD1 4.29Å; L132-L228 HydrophobicContact CD1-CD2 3.97Å; M133-L228 HydrophobicContact CG-CD1 4.41Å; M133-L228 HydrophobicContact SD-CD1 3.9Å; I224-L228 HydrophobicContact CG2-CD1 4.07Å; I224-L228 HydrophobicContact CG2-CG 4.35Å; I224-L228 WeakPolarHBondContact O-CG 3.42Å; I224-L228 PolarHBondContact O-N 3.22Å; F225-L228 PolarHBondContact O-N 2.57Å; L228-Y231 WeakPolarHBondContact O-CE1 3.35Å
229	L	95.8	Very high	94.2	Very high	13 Å²	13	28.5 Å²	28.5	7%	0.068	13%	0.126	C	C	.	.	H	α-helix	trans	-71.2	-42.3	178	-66.5	171.2	0	0	0	111.8	V129 F225 A226 E227 F304 V306 E310 L314	V129-L229 HydrophobicContact CG1-CD2 4.15Å; F225-L229 HydrophobicContact CD2-CD1 4.08Å; F225-L229 HydrophobicContact CD2-CG 4.05Å; F225-L229 HydrophobicContact CE2-CD1 3.86Å; F225-L229 HydrophobicContact CE2-CD2 3.94Å; F225-L229 HydrophobicContact CE2-CG 3.9Å; F225-L229 HydrophobicContact CZ-CD1 4.1Å; F225-L229 WeakPolarHBondContact O-CG 3.42Å; F225-L229 PolarHBondContact O-N 2.92Å; A226-L229 PolarHBondContact O-N 2.91Å; E227-L229 VanDerWaalsContact C-N 3.33Å; E227-L229 PolarHBondContact O-N 3.42Å; L229-F304 HydrophobicContact CB-CE1 4.33Å; L229-F304 HydrophobicContact CB-CZ 4.43Å; L229-F304 WeakPolarHBondContact O-CE2 3.48Å; L229-F304 WeakPolarHBondContact O-CZ 3.32Å; L229-V306 HydrophobicContact CD1-CG2 4.3Å; L229-E310 HydrophobicContact CD1-CB 4.33Å; L229-E310 HydrophobicContact CD2-CG 4.32Å; L229-L314 HydrophobicContact CD1-CD2 4.45Å
230	T	94.6	Very high	92.3	Very high	7 Å²	7	32 Å²	32	4%	0.043	14%	0.142	C	C	.	.	H	α-helix	trans	-103.5	-16.3	-169.2	61.9	0	0	0	0	115	A226 E232 F299 F304	A226-T230 WeakPolarHBondContact O-CG2 3.21Å; A226-T230 PolarHBondContact O-N 3.04Å; A226-T230 PolarHBondContact O-OG1 3.49Å; T230-E232 PolarHBondContact O-N 3.27Å; T230-E232 PolarHBondContact OG1-N 3.12Å; T230-E232 PolarHBondContact OG1-O 3.39Å; T230-E232 VanDerWaalsContact OG1-O 3.06Å; T230-F299 HydrophobicContact CG2-CD1 4.25Å; T230-F299 HydrophobicContact CG2-CE1 3.6Å; T230-F304 HydrophobicContact CG2-CD1 4.3Å; T230-F304 HydrophobicContact CG2-CE1 4.43Å; T230-F304 HydrophobicContact CG2-CG 4.45Å
231	Y	95.2	Very high	90.1	Very high	59 Å²	59	37.4 Å²	37.4	23%	0.231	17%	0.171	C	C	.	.	S	Bend	trans	61.5	17.1	-166.8	-45.9	-51.6	0	0	0	114.8	H112 R113 K116 E227 L228	H112-Y231 HydrophobicContact CB-CD1 3.49Å; H112-Y231 VanDerWaalsContact CB-CD1 3.49Å; H112-Y231 HydrophobicContact CB-CD2 3.78Å; H112-Y231 HydrophobicContact CB-CE1 3.44Å; H112-Y231 VanDerWaalsContact CB-CE1 3.44Å; H112-Y231 HydrophobicContact CB-CE2 3.73Å; H112-Y231 HydrophobicContact CB-CG 3.66Å; H112-Y231 AromaticContact CG-CE1 3.63Å; H112-Y231 AromaticContact CG-CZ 3.62Å; H112-Y231 AromaticContact ND1-CZ 3.8Å; R113-Y231 WeakPolarHBondContact CD-O 3.43Å; K116-Y231 HydrophobicContact CD-CD2 4.39Å; E227-Y231 WeakPolarHBondContact O-CA 3.41Å; E227-Y231 PolarHBondContact O-N 2.87Å; L228-Y231 WeakPolarHBondContact O-CE1 3.35Å
232	E	94.4	Very high	88	Confident	67 Å²	67	39.7 Å²	39.7	31%	0.313	18%	0.183	S	C	.	.	S	Bend	trans	-129.7	134.5	178.5	-67.9	-179.1	-170.3	0	0	110.2	T230 I234 K302	T230-E232 PolarHBondContact O-N 3.27Å; T230-E232 PolarHBondContact OG1-N 3.12Å; T230-E232 PolarHBondContact OG1-O 3.39Å; T230-E232 VanDerWaalsContact OG1-O 3.06Å; E232-I234 PolarHBondContact O-N 3.49Å; E232-I234 VanDerWaalsContact O-N 3.08Å; E232-K302 IonicContact OE2-NZ 3.74Å; E232-K302 PolarHBondContact OE2-NZ 2.87Å
233	P	95.9	Very high	85.9	Confident	9 Å²	9	47.7 Å²	47.7	6%	0.058	22%	0.217	C	C	.	.			trans	-61.3	118.1	175.7	-15.6	25.3	0	0	0	109.9	W199 F235 H236	W199-P233 HydrophobicContact CD2-CB 4.49Å; W199-P233 HydrophobicContact CE3-CB 3.87Å; W199-P233 HydrophobicContact CE3-CG 3.89Å; W199-P233 HydrophobicContact CZ3-CB 4.35Å; W199-P233 HydrophobicContact CZ3-CG 3.86Å; P233-F235 VanDerWaalsContact C-N 3.25Å; P233-F235 PolarHBondContact O-N 3.29Å; P233-H236 HydrophobicContact CB-CB 4.1Å; P233-H236 HydrophobicContact CG-CB 4.49Å; P233-H236 WeakPolarHBondContact O-CB 3.37Å; P233-H236 PolarHBondContact O-N 2.96Å
234	I	97.4	Very high	84.1	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-40	-173	-175.9	167.7	0	0	0	112	C223 A226 E232 R255 V259 L295 Y298 L318	C223-I234 HydrophobicContact CB-CG2 4.26Å; A226-I234 HydrophobicContact CB-CB 3.75Å; A226-I234 HydrophobicContact CB-CD1 3.64Å; A226-I234 HydrophobicContact CB-CG1 4.25Å; A226-I234 HydrophobicContact CB-CG2 3.87Å; E232-I234 PolarHBondContact O-N 3.49Å; E232-I234 VanDerWaalsContact O-N 3.08Å; I234-R255 PolarHBondContact O-NE 2.88Å; I234-R255 VanDerWaalsContact O-NE 3.13Å; I234-R255 PolarHBondContact O-NH2 2.92Å; I234-V259 HydrophobicContact CD1-CG1 3.82Å; I234-V259 HydrophobicContact CG1-CG1 3.74Å; I234-L295 HydrophobicContact CD1-CD1 3.74Å; I234-Y298 HydrophobicContact CD1-CE1 4.46Å; I234-Y298 HydrophobicContact CG1-CE1 4.15Å; I234-L318 HydrophobicContact CD1-CD1 3.9Å
235	F	96.6	Very high	82.6	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	35.7	177.7	-48.8	-56.3	0	0	0	113.4	W219 C223 P233 C237 Q252 R255 I256 V259 M260 L318	W219-F235 AromaticContact CE2-CE2 3.83Å; W219-F235 HydrophobicContact CH2-CE2 4.13Å; W219-F235 HydrophobicContact CH2-CZ 4.07Å; W219-F235 HydrophobicContact CZ2-CD2 4.07Å; W219-F235 AromaticContact CZ2-CE2 3.34Å; W219-F235 HydrophobicContact CZ2-CE2 3.34Å; W219-F235 AromaticContact CZ2-CZ 3.7Å; W219-F235 HydrophobicContact CZ2-CZ 3.7Å; C223-F235 VanDerWaalsContact SG-CD2 3.55Å; C223-F235 WeakPolarHBondContact SG-CE2 3.43Å; P233-F235 VanDerWaalsContact C-N 3.25Å; P233-F235 PolarHBondContact O-N 3.29Å; F235-C237 PolarHBondContact O-N 3.26Å; F235-Q252 PolarHBondContact O-NE2 3.3Å; F235-R255 HydrophobicContact CB-CG 4.18Å; F235-I256 HydrophobicContact CB-CG1 4.34Å; F235-I256 HydrophobicContact CD1-CB 4.38Å; F235-I256 HydrophobicContact CD1-CG1 3.87Å; F235-I256 HydrophobicContact CD2-CG1 4.32Å; F235-I256 HydrophobicContact CE1-CB 4.47Å; F235-I256 HydrophobicContact CE1-CG1 4.24Å; F235-I256 HydrophobicContact CE1-CG2 4.48Å; F235-I256 HydrophobicContact CG-CG1 3.92Å; F235-V259 HydrophobicContact CD1-CB 4.16Å; F235-V259 HydrophobicContact CD1-CG1 4.41Å; F235-V259 HydrophobicContact CD1-CG2 4.25Å; F235-V259 HydrophobicContact CE1-CB 3.81Å; F235-V259 HydrophobicContact CE1-CG1 3.78Å; F235-V259 HydrophobicContact CE1-CG2 4.38Å; F235-M260 HydrophobicContact CE1-CG 3.85Å; F235-M260 HydrophobicContact CE1-SD 4.19Å; F235-M260 HydrophobicContact CZ-CG 3.89Å; F235-M260 HydrophobicContact CZ-SD 3.96Å; F235-L318 HydrophobicContact CE2-CD1 4.43Å; F235-L318 HydrophobicContact CE2-CD2 4.02Å; F235-L318 HydrophobicContact CZ-CD1 4.16Å; F235-L318 HydrophobicContact CZ-CD2 4.37Å
236	H	93.2	Very high	81.7	Confident	88 Å²	88	60.6 Å²	60.6	41%	0.407	30%	0.302	S	S	.	.			trans	-52.9	123.9	173.4	-178.8	-81.4	0	0	0	111.3	W199 P233	W199-H236 AromaticContact CE2-CD2 3.95Å; W199-H236 AromaticContact CH2-CD2 3.56Å; W199-H236 AromaticContact CH2-NE2 3.85Å; W199-H236 AromaticContact CZ2-CD2 3.48Å; W199-H236 VanDerWaalsContact CZ2-CD2 3.48Å; W199-H236 WeakPolarHBondContact CZ2-CD2 3.29Å; W199-H236 AromaticContact CZ2-NE2 3.65Å; P233-H236 HydrophobicContact CB-CB 4.1Å; P233-H236 HydrophobicContact CG-CB 4.49Å; P233-H236 WeakPolarHBondContact O-CB 3.37Å; P233-H236 PolarHBondContact O-N 2.96Å
237	C	85.7	Confident	80.9	Confident	13 Å²	13	62.8 Å²	62.8	9%	0.088	32%	0.316	C	S	.	.			trans	-132.5	144.4	177.7	-172.3	0	0	0	0	108.7	W199 F235 E251	W199-C237 PolarHBondContact NE1-O 2.85Å; F235-C237 PolarHBondContact O-N 3.26Å; C237-E251 VanDerWaalsContact SG-C 3.58Å; C237-E251 WeakPolarHBondContact SG-CB 3.32Å
238	R	78.3	Confident	80.5	Confident	210 Å²	210	63.8 Å²	63.8	79%	0.792	32%	0.32	S	S	*	.			trans	-65	146.2	175.4	-72.7	-177.2	176.1	170.5	-1.2	108.4	E240	R238-E240 PolarHBondContact O-N 3.49Å
239	Q	66.3	Low	80	Confident	111 Å²	111	64.2 Å²	64.2	52%	0.519	32%	0.321	S	S	.	.			trans	-72.9	101.9	178	-164.2	165	-6.3	0	0	108.2	V196 I242	V196-Q239 PolarHBondContact O-NE2 3.26Å; Q239-I242 HydrophobicContact CG-CD1 4.21Å; Q239-I242 HydrophobicContact CG-CG1 4.39Å
240	E	59	Low	79.8	Confident	72 Å²	72	67 Å²	67	34%	0.336	33%	0.333	S	S	.	.			trans	-59.5	142.6	160.7	-67.4	177.9	-157.7	0	0	107.4	R238 I242 E251	R238-E240 PolarHBondContact O-N 3.49Å; E240-I242 WeakPolarHBondContact O-CG1 3.35Å; E240-I242 PolarHBondContact O-N 2.82Å; E240-E251 HydrophobicContact CG-CG 4.46Å; E240-E251 WeakPolarHBondContact OE1-CB 3.46Å; E240-E251 WeakPolarHBondContact OE1-CG 3.46Å; E240-E251 PolarHBondContact OE1-N 2.84Å
241	D	52	Low	79.6	Confident	119 Å²	119	70.8 Å²	70.8	64%	0.636	35%	0.35	S	S	*	.			trans	-49.5	107.3	169.6	-82.8	-26.2	0	0	0	108.2	K243	D241-K243 HydrophobicContact CB-CD 3.72Å; D241-K243 HydrophobicContact CB-CG 3.93Å; D241-K243 PolarHBondContact O-N 2.94Å; D241-K243 WeakPolarHBondContact OD2-CE 3.43Å; D241-K243 IonicContact OD2-NZ 2.67Å; D241-K243 PolarHBondContact OD2-NZ 2.69Å
242	I	55.7	Low	79.5	Confident	49 Å²	49	68.2 Å²	68.2	25%	0.251	34%	0.34	S	S	.	.			trans	-72.1	63.7	179	-53	175.1	0	0	0	107.5	V194 V196 F198 Q239 E240	V194-I242 HydrophobicContact CG1-CG2 3.97Å; V196-I242 VanDerWaalsContact CA-CD1 3.43Å; V196-I242 HydrophobicContact CB-CD1 4.4Å; V196-I242 HydrophobicContact CG1-CD1 4.35Å; V196-I242 WeakPolarHBondContact O-CD1 3.47Å; F198-I242 HydrophobicContact CE2-CD1 4.17Å; F198-I242 HydrophobicContact CE2-CG1 4.3Å; F198-I242 HydrophobicContact CZ-CG2 4.47Å; Q239-I242 HydrophobicContact CG-CD1 4.21Å; Q239-I242 HydrophobicContact CG-CG1 4.39Å; E240-I242 WeakPolarHBondContact O-CG1 3.35Å; E240-I242 PolarHBondContact O-N 2.82Å
243	K	53.6	Low	79.5	Confident	168 Å²	168	65 Å²	65	73%	0.73	33%	0.325	S	S	*	.			trans	-92.1	-11.7	180	-78	172	-179.1	162.5	0	110.7	D241	D241-K243 HydrophobicContact CB-CD 3.72Å; D241-K243 HydrophobicContact CB-CG 3.93Å; D241-K243 PolarHBondContact O-N 2.94Å; D241-K243 WeakPolarHBondContact OD2-CE 3.43Å; D241-K243 IonicContact OD2-NZ 2.67Å; D241-K243 PolarHBondContact OD2-NZ 2.69Å
244	T	60.4	Low	79.5	Confident	76 Å²	76	66.5 Å²	66.5	47%	0.466	33%	0.332	S	S	.	.			trans	-115.1	131	-179.5	66.7	0	0	0	0	110.7	T246	T244-T246 WeakPolarHBondContact CB-OG1 3.48Å; T244-T246 PolarHBondContact O-N 2.73Å; T244-T246 VanDerWaalsContact O-N 3.11Å; T244-T246 PolarHBondContact OG1-OG1 3.08Å
245	S	68.8	Low	79.4	Confident	132 Å²	132	69.5 Å²	69.5	92%	0.923	34%	0.343	S	S	*	.			trans	-74.3	15.5	169.8	59.3	0	0	0	0	112.5
246	T	79.9	Confident	79.4	Confident	64 Å²	64	69.5 Å²	69.5	39%	0.393	34%	0.343	S	S	.	.			trans	-79.8	138	-175.7	54.7	0	0	0	0	109.8	T244 Y248 H249	T244-T246 WeakPolarHBondContact CB-OG1 3.48Å; T244-T246 PolarHBondContact O-N 2.73Å; T244-T246 VanDerWaalsContact O-N 3.11Å; T244-T246 PolarHBondContact OG1-OG1 3.08Å; T246-Y248 VanDerWaalsContact C-N 3.25Å; T246-Y248 PolarHBondContact O-N 3.41Å; T246-H249 PolarHBondContact O-CE1 3.33Å; T246-H249 PolarHBondContact O-NE2 3.39Å
247	P	81.1	Confident	79.6	Confident	47 Å²	47	65.3 Å²	65.3	31%	0.305	32%	0.323	S	S	.	.	S	Bend	trans	-68.3	-26.3	175.9	27	-33.5	0	0	0	112.9	L206 H249	L206-P247 WeakPolarHBondContact CA-O 3.28Å; P247-H249 PolarHBondContact O-CD2 2.99Å; P247-H249 PolarHBondContact O-N 2.85Å
248	Y	88.4	Confident	80.2	Confident	27 Å²	27	70.7 Å²	70.7	11%	0.106	34%	0.342	C	S	.	.			trans	-74.8	118.5	-179.1	-171.2	-93.6	0	0	0	112.5	L206 L207 T246 K250 L253 D276 Q279 L280 D283	L206-Y248 WeakPolarHBondContact O-CA 3.33Å; L207-Y248 HydrophobicContact CD2-CE2 4.26Å; T246-Y248 VanDerWaalsContact C-N 3.25Å; T246-Y248 PolarHBondContact O-N 3.41Å; Y248-K250 HydrophobicContact CE1-CB 4Å; Y248-L253 HydrophobicContact CD2-CD1 3.81Å; Y248-L253 HydrophobicContact CE2-CD1 3.34Å; Y248-D276 HydrophobicContact CD2-CB 3.67Å; Y248-D276 HydrophobicContact CE2-CB 4.46Å; Y248-D276 HydrophobicContact CG-CB 4.34Å; Y248-Q279 HydrophobicContact CD1-CG 3.66Å; Y248-Q279 HydrophobicContact CD2-CB 4.29Å; Y248-Q279 HydrophobicContact CD2-CG 4.14Å; Y248-Q279 HydrophobicContact CE1-CB 4.46Å; Y248-Q279 HydrophobicContact CE1-CG 3.44Å; Y248-Q279 VanDerWaalsContact CE1-CG 3.44Å; Y248-Q279 HydrophobicContact CE2-CB 4.1Å; Y248-Q279 HydrophobicContact CE2-CG 3.94Å; Y248-Q279 HydrophobicContact CG-CG 4.01Å; Y248-L280 HydrophobicContact CE2-CB 4.23Å; Y248-L280 WeakPolarHBondContact OH-CA 3.48Å; Y248-D283 WeakPolarHBondContact CE1-OD2 3.33Å; Y248-D283 PolarHBondContact OH-OD2 3.01Å
249	H	88.3	Confident	81.1	Confident	14 Å²	14	60.7 Å²	60.7	7%	0.065	30%	0.304	C	S	.	.			trans	-126.3	106.7	175.5	-61.5	-73.7	0	0	0	110.2	F198 L206 T246 P247 Q252 L253	F198-H249 AromaticContact CD2-CD2 3.92Å; F198-H249 AromaticContact CD2-CG 3.97Å; F198-H249 AromaticContact CD2-NE2 3.99Å; F198-H249 AromaticContact CE1-CD2 3.98Å; F198-H249 AromaticContact CE1-NE2 3.47Å; F198-H249 WeakPolarHBondContact CE1-NE2 3.35Å; F198-H249 AromaticContact CE2-CD2 3.84Å; F198-H249 AromaticContact CE2-CE1 3.32Å; F198-H249 WeakPolarHBondContact CE2-CE1 3.4Å; F198-H249 AromaticContact CE2-CG 3.97Å; F198-H249 AromaticContact CE2-ND1 3.65Å; F198-H249 AromaticContact CE2-NE2 3.42Å; F198-H249 WeakPolarHBondContact CE2-NE2 3.42Å; F198-H249 AromaticContact CZ-CD2 3.87Å; F198-H249 AromaticContact CZ-CE1 3.37Å; F198-H249 WeakPolarHBondContact CZ-CE1 3.42Å; F198-H249 AromaticContact CZ-NE2 3.12Å; F198-H249 WeakPolarHBondContact CZ-NE2 3.42Å; L206-H249 HydrophobicContact CD2-CB 4.25Å; T246-H249 PolarHBondContact O-CE1 3.33Å; T246-H249 PolarHBondContact O-NE2 3.39Å; P247-H249 PolarHBondContact O-CD2 2.99Å; P247-H249 PolarHBondContact O-N 2.85Å; H249-Q252 HydrophobicContact CB-CB 4Å; H249-L253 PolarHBondContact O-N 3.36Å; H249-L253 VanDerWaalsContact O-N 3.12Å
250	K	91.2	Very high	82.6	Confident	73 Å²	73	56.8 Å²	56.8	32%	0.317	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-56.8	-171.8	-179	-176.8	178.4	160.5	0	112.3	Y248 Q252 L253 E254 D283 I285	Y248-K250 HydrophobicContact CE1-CB 4Å; K250-Q252 PolarHBondContact O-N 2.81Å; K250-L253 PolarHBondContact O-N 2.85Å; K250-L253 VanDerWaalsContact O-N 3.09Å; K250-E254 VanDerWaalsContact CE-OE1 3.27Å; K250-E254 WeakPolarHBondContact CE-OE1 3.46Å; K250-E254 HydrophobicContact CG-CG 4.32Å; K250-E254 WeakPolarHBondContact O-CG 3.41Å; K250-E254 PolarHBondContact O-N 3.44Å; K250-D283 HydrophobicContact CD-CB 4.27Å; K250-D283 WeakPolarHBondContact CE-OD1 3.48Å; K250-D283 IonicContact NZ-OD1 3.44Å; K250-D283 PolarHBondContact NZ-OD1 3.02Å; K250-I285 HydrophobicContact CG-CD1 4.31Å
251	E	90.7	Very high	84.4	Confident	85 Å²	85	53.5 Å²	53.5	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-33.1	-175	-70.4	178.6	-168.6	0	0	111.7	C237 E240 R255	C237-E251 VanDerWaalsContact SG-C 3.58Å; C237-E251 WeakPolarHBondContact SG-CB 3.32Å; E240-E251 HydrophobicContact CG-CG 4.46Å; E240-E251 WeakPolarHBondContact OE1-CB 3.46Å; E240-E251 WeakPolarHBondContact OE1-CG 3.46Å; E240-E251 PolarHBondContact OE1-N 2.84Å; E251-R255 WeakPolarHBondContact O-CB 3.21Å; E251-R255 PolarHBondContact O-N 3.07Å
252	Q	92.6	Very high	86.5	Confident	5 Å²	5	48.9 Å²	48.9	2%	0.023	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-44	175.8	-171.6	62.8	69.8	0	0	111.9	F198 L206 F235 H249 K250 R255 I256	F198-Q252 HydrophobicContact CB-CG 3.94Å; L206-Q252 HydrophobicContact CD1-CB 4.21Å; L206-Q252 HydrophobicContact CD1-CG 3.58Å; L206-Q252 HydrophobicContact CD2-CG 4.29Å; F235-Q252 PolarHBondContact O-NE2 3.3Å; H249-Q252 HydrophobicContact CB-CB 4Å; K250-Q252 PolarHBondContact O-N 2.81Å; Q252-R255 PolarHBondContact O-N 2.96Å; Q252-I256 WeakPolarHBondContact O-CG1 3.48Å; Q252-I256 PolarHBondContact O-N 2.96Å
253	L	95	Very high	88.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-45.4	174.3	-79.1	168.1	0	0	0	111.5	L206 L207 Y248 H249 K250 R255 I256 F257 I285	L206-L253 HydrophobicContact CB-CD1 4.28Å; L206-L253 HydrophobicContact CB-CD2 3.77Å; L206-L253 HydrophobicContact CB-CG 3.89Å; L206-L253 HydrophobicContact CD1-CD2 4.07Å; L206-L253 HydrophobicContact CD1-CG 4.17Å; L207-L253 HydrophobicContact CD2-CD1 3.87Å; L207-L253 HydrophobicContact CD2-CD2 4.33Å; L207-L253 HydrophobicContact CG-CD2 4.23Å; Y248-L253 HydrophobicContact CD2-CD1 3.81Å; Y248-L253 HydrophobicContact CE2-CD1 3.34Å; H249-L253 PolarHBondContact O-N 3.36Å; H249-L253 VanDerWaalsContact O-N 3.12Å; K250-L253 PolarHBondContact O-N 2.85Å; K250-L253 VanDerWaalsContact O-N 3.09Å; L253-R255 VanDerWaalsContact C-N 3.27Å; L253-R255 PolarHBondContact O-N 3Å; L253-I256 PolarHBondContact O-N 3.21Å; L253-I256 VanDerWaalsContact O-N 3.13Å; L253-F257 HydrophobicContact CB-CD2 4.41Å; L253-F257 HydrophobicContact CB-CE2 4.03Å; L253-F257 HydrophobicContact CD2-CE2 4.08Å; L253-F257 HydrophobicContact CD2-CZ 4.26Å; L253-F257 WeakPolarHBondContact O-CD2 3.47Å; L253-F257 WeakPolarHBondContact O-CG 3.27Å; L253-F257 PolarHBondContact O-N 2.95Å; L253-I285 HydrophobicContact CB-CD1 4.48Å
254	E	95.3	Very high	90.3	Very high	41 Å²	41	41 Å²	41	19%	0.192	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-41.7	175.2	-69.5	-171.5	156.6	0	0	111.4	K250 F257 R258 I285 Y290	K250-E254 VanDerWaalsContact CE-OE1 3.27Å; K250-E254 WeakPolarHBondContact CE-OE1 3.46Å; K250-E254 HydrophobicContact CG-CG 4.32Å; K250-E254 WeakPolarHBondContact O-CG 3.41Å; K250-E254 PolarHBondContact O-N 3.44Å; E254-F257 PolarHBondContact O-N 3.39Å; E254-R258 WeakPolarHBondContact O-CB 3.46Å; E254-R258 VanDerWaalsContact O-CG 3.28Å; E254-R258 WeakPolarHBondContact O-CG 3.12Å; E254-R258 PolarHBondContact O-N 2.92Å; E254-I285 HydrophobicContact CG-CD1 3.61Å; E254-I285 HydrophobicContact CG-CG1 4.03Å; E254-Y290 WeakPolarHBondContact CG-OH 3.48Å
255	R	95.8	Very high	91.8	Very high	65 Å²	65	41.8 Å²	41.8	25%	0.245	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.3	176.7	60.5	-174.2	179.7	1.2	111.7	I234 F235 E251 Q252 L253 R258 V259	I234-R255 PolarHBondContact O-NE 2.88Å; I234-R255 VanDerWaalsContact O-NE 3.13Å; I234-R255 PolarHBondContact O-NH2 2.92Å; F235-R255 HydrophobicContact CB-CG 4.18Å; E251-R255 WeakPolarHBondContact O-CB 3.21Å; E251-R255 PolarHBondContact O-N 3.07Å; Q252-R255 PolarHBondContact O-N 2.96Å; L253-R255 VanDerWaalsContact C-N 3.27Å; L253-R255 PolarHBondContact O-N 3Å; R255-R258 PolarHBondContact O-N 3.25Å; R255-V259 WeakPolarHBondContact O-CG2 3.35Å; R255-V259 PolarHBondContact O-N 3.46Å
256	I	97.3	Very high	93	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-49.6	176.1	-69.2	167.3	0	0	0	110	P203 L206 W219 F235 Q252 L253 R258 V259 M260	P203-I256 HydrophobicContact CB-CD1 4.41Å; L206-I256 HydrophobicContact CD1-CD1 3.57Å; W219-I256 HydrophobicContact CH2-CG2 4.08Å; W219-I256 HydrophobicContact CZ2-CD1 4.15Å; W219-I256 HydrophobicContact CZ2-CG1 4.34Å; W219-I256 HydrophobicContact CZ2-CG2 4.21Å; F235-I256 HydrophobicContact CB-CG1 4.34Å; F235-I256 HydrophobicContact CD1-CB 4.38Å; F235-I256 HydrophobicContact CD1-CG1 3.87Å; F235-I256 HydrophobicContact CD2-CG1 4.32Å; F235-I256 HydrophobicContact CE1-CB 4.47Å; F235-I256 HydrophobicContact CE1-CG1 4.24Å; F235-I256 HydrophobicContact CE1-CG2 4.48Å; F235-I256 HydrophobicContact CG-CG1 3.92Å; Q252-I256 WeakPolarHBondContact O-CG1 3.48Å; Q252-I256 PolarHBondContact O-N 2.96Å; L253-I256 PolarHBondContact O-N 3.21Å; L253-I256 VanDerWaalsContact O-N 3.13Å; I256-R258 VanDerWaalsContact C-N 3.34Å; I256-R258 PolarHBondContact O-N 3.43Å; I256-V259 PolarHBondContact O-N 2.94Å; I256-V259 VanDerWaalsContact O-N 3.08Å; I256-M260 HydrophobicContact CG2-CG 4.2Å; I256-M260 WeakPolarHBondContact O-CB 3.39Å; I256-M260 PolarHBondContact O-N 3.27Å
257	F	97.4	Very high	93.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70.8	-25.3	-177.6	-61.2	-52.2	0	0	0	114	L253 E254 V259 G261 Y262 P263 L280 I285 Y290 M320	L253-F257 HydrophobicContact CB-CD2 4.41Å; L253-F257 HydrophobicContact CB-CE2 4.03Å; L253-F257 HydrophobicContact CD2-CE2 4.08Å; L253-F257 HydrophobicContact CD2-CZ 4.26Å; L253-F257 WeakPolarHBondContact O-CD2 3.47Å; L253-F257 WeakPolarHBondContact O-CG 3.27Å; L253-F257 PolarHBondContact O-N 2.95Å; E254-F257 PolarHBondContact O-N 3.39Å; F257-V259 VanDerWaalsContact C-N 3.29Å; F257-G261 CarbonylContact O-C 3.55Å; F257-G261 WeakPolarHBondContact O-CA 3.49Å; F257-G261 PolarHBondContact O-N 3.33Å; F257-Y262 HydrophobicContact CD1-CD2 4.4Å; F257-P263 HydrophobicContact CE1-CG 4.43Å; F257-L280 HydrophobicContact CE2-CD1 3.65Å; F257-L280 HydrophobicContact CZ-CD1 3.79Å; F257-I285 HydrophobicContact CD2-CG2 3.31Å; F257-I285 HydrophobicContact CE2-CG2 3.5Å; F257-I285 HydrophobicContact CG-CG2 4.29Å; F257-Y290 HydrophobicContact CB-CD1 4.03Å; F257-Y290 HydrophobicContact CB-CD2 4.08Å; F257-Y290 HydrophobicContact CB-CG 3.75Å; F257-M320 HydrophobicContact CD1-SD 4.22Å; F257-M320 HydrophobicContact CE1-SD 3.94Å
258	R	96.7	Very high	94.5	Very high	126 Å²	126	37.7 Å²	37.7	48%	0.475	18%	0.184	S	C	.	.	H	α-helix	trans	-68.8	-27.1	169.6	-75.3	-178.6	-170.5	-150.6	6.3	113.1	E254 R255 I256 Y290 Y293	E254-R258 WeakPolarHBondContact O-CB 3.46Å; E254-R258 VanDerWaalsContact O-CG 3.28Å; E254-R258 WeakPolarHBondContact O-CG 3.12Å; E254-R258 PolarHBondContact O-N 2.92Å; R255-R258 PolarHBondContact O-N 3.25Å; I256-R258 VanDerWaalsContact C-N 3.34Å; I256-R258 PolarHBondContact O-N 3.43Å; R258-Y290 HydrophobicContact CG-CD1 3.93Å; R258-Y290 HydrophobicContact CG-CE1 3.56Å; R258-Y293 WeakPolarHBondContact O-CB 3.16Å; R258-Y293 WeakPolarHBondContact O-CD1 3.39Å; R258-Y293 VanDerWaalsContact O-CG 3.27Å
259	V	97.5	Very high	94.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-93.5	-47.4	179.8	173.2	0	0	0	0	111.1	I234 F235 R255 I256 F257 S294 L295 Y298	I234-V259 HydrophobicContact CD1-CG1 3.82Å; I234-V259 HydrophobicContact CG1-CG1 3.74Å; F235-V259 HydrophobicContact CD1-CB 4.16Å; F235-V259 HydrophobicContact CD1-CG1 4.41Å; F235-V259 HydrophobicContact CD1-CG2 4.25Å; F235-V259 HydrophobicContact CE1-CB 3.81Å; F235-V259 HydrophobicContact CE1-CG1 3.78Å; F235-V259 HydrophobicContact CE1-CG2 4.38Å; R255-V259 WeakPolarHBondContact O-CG2 3.35Å; R255-V259 PolarHBondContact O-N 3.46Å; I256-V259 PolarHBondContact O-N 2.94Å; I256-V259 VanDerWaalsContact O-N 3.08Å; F257-V259 VanDerWaalsContact C-N 3.29Å; V259-S294 CarbonylContact O-C 3.54Å; V259-L295 HydrophobicContact CG1-CD1 4.28Å; V259-L295 WeakPolarHBondContact O-CA 3.31Å; V259-L295 PolarHBondContact O-N 2.92Å; V259-L295 VanDerWaalsContact O-N 3.15Å; V259-Y298 HydrophobicContact CG1-CD1 4.26Å; V259-Y298 HydrophobicContact CG1-CD2 4.28Å; V259-Y298 HydrophobicContact CG1-CG 3.93Å; V259-Y298 HydrophobicContact CG2-CD2 3.98Å; V259-Y298 HydrophobicContact CG2-CE2 4.28Å; V259-Y298 HydrophobicContact CG2-CG 4.46Å
260	M	97.9	Very high	95.1	Very high	28 Å²	28	43 Å²	43	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-91.8	-15.6	-172.8	-59.3	-56.6	-62.1	0	0	113.6	F235 I256 L295 L318 M320	F235-M260 HydrophobicContact CE1-CG 3.85Å; F235-M260 HydrophobicContact CE1-SD 4.19Å; F235-M260 HydrophobicContact CZ-CG 3.89Å; F235-M260 HydrophobicContact CZ-SD 3.96Å; I256-M260 HydrophobicContact CG2-CG 4.2Å; I256-M260 WeakPolarHBondContact O-CB 3.39Å; I256-M260 PolarHBondContact O-N 3.27Å; M260-L295 HydrophobicContact CE-CB 4.23Å; M260-L295 HydrophobicContact CE-CD2 4.3Å; M260-L295 HydrophobicContact SD-CB 4.17Å; M260-L295 HydrophobicContact SD-CD1 3.97Å; M260-L295 HydrophobicContact SD-CG 4.46Å; M260-L318 HydrophobicContact CE-CB 3.79Å; M260-L318 WeakPolarHBondContact CE-O 3.29Å; M260-L318 HydrophobicContact SD-CB 4.35Å; M260-L318 HydrophobicContact SD-CD1 4.26Å; M260-M320 HydrophobicContact CB-CE 4.1Å; M260-M320 HydrophobicContact CB-SD 4.43Å
261	G	97.4	Very high	95.4	Very high	4 Å²	4	39.6 Å²	39.6	4%	0.041	20%	0.203	C	C	.	.			trans	80.4	165.5	-164.2	0	0	0	0	0	112.8	F257 Y290 Y293 M320	F257-G261 CarbonylContact O-C 3.55Å; F257-G261 WeakPolarHBondContact O-CA 3.49Å; F257-G261 PolarHBondContact O-N 3.33Å; G261-Y290 WeakPolarHBondContact CA-O 3.45Å; G261-Y293 WeakPolarHBondContact CA-O 3.49Å; G261-M320 VanDerWaalsContact O-CE 3.28Å; G261-M320 WeakPolarHBondContact O-CE 3.46Å
262	Y	96.7	Very high	95.6	Very high	21 Å²	21	40.5 Å²	40.5	8%	0.082	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-75.9	129.8	170.1	-164	-92.3	0	0	0	110	F257 M271 L280 I285 S286 K287 Y290	F257-Y262 HydrophobicContact CD1-CD2 4.4Å; Y262-M271 HydrophobicContact CE1-CE 3.75Å; Y262-M271 WeakPolarHBondContact OH-CE 3.32Å; Y262-L280 HydrophobicContact CE2-CD2 4.06Å; Y262-I285 HydrophobicContact CD2-CG2 4.47Å; Y262-I285 HydrophobicContact CE2-CG2 4.31Å; Y262-S286 VanDerWaalsContact CD2-C 3.46Å; Y262-K287 HydrophobicContact CD1-CB 3.74Å; Y262-K287 HydrophobicContact CD1-CG 4.49Å; Y262-K287 HydrophobicContact CE1-CB 4.26Å; Y262-K287 HydrophobicContact CG-CB 4.27Å; Y262-Y290 PolarHBondContact N-O 3.28Å
263	P	95.3	Very high	95.7	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-65.2	129.3	-178.5	25.1	-30.3	0	0	0	109.6	F257 A267 W268 M271 M320	F257-P263 HydrophobicContact CE1-CG 4.43Å; P263-A267 HydrophobicContact CB-CB 4.31Å; P263-W268 HydrophobicContact CB-CB 4.2Å; P263-W268 HydrophobicContact CG-CE3 4.25Å; P263-M271 HydrophobicContact CG-CE 3.89Å; P263-M271 HydrophobicContact CG-SD 3.61Å; P263-M320 HydrophobicContact CB-CE 3.59Å; P263-M320 HydrophobicContact CB-SD 4.02Å; P263-M320 HydrophobicContact CG-CE 3.98Å; P263-M320 HydrophobicContact CG-SD 3.84Å
264	P	93.2	Very high	95.6	Very high	52 Å²	52	49 Å²	49	34%	0.338	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-64	158.5	167.4	29.8	-35.1	0	0	0	110.3	D266 A267 W268	P264-D266 VanDerWaalsContact CB-OD1 3.28Å; P264-D266 WeakPolarHBondContact CB-OD1 3.24Å; P264-D266 WeakPolarHBondContact CG-OD1 3.3Å; P264-D266 PolarHBondContact O-N 2.97Å; P264-D266 VanDerWaalsContact O-N 3.14Å; P264-A267 HydrophobicContact CG-CB 3.65Å; P264-A267 WeakPolarHBondContact O-CB 3.49Å; P264-A267 PolarHBondContact O-N 3.38Å; P264-W268 PolarHBondContact O-N 3.43Å
265	D	92	Very high	95.5	Very high	92 Å²	92	50.1 Å²	50.1	49%	0.492	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.5	-172.9	-80	8.4	0	0	0	113.3	W268 V269 K272	D265-W268 CarbonylContact O-C 3.32Å; D265-V269 WeakPolarHBondContact O-CA 3.28Å; D265-V269 PolarHBondContact O-N 3.44Å; D265-K272 IonicContact OD1-NZ 2.75Å; D265-K272 IonicContact OD2-NZ 2.85Å; D265-K272 PolarHBondContact OD2-NZ 2.92Å
266	D	94.4	Very high	95.4	Very high	116 Å²	116	49 Å²	49	62%	0.62	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-27.8	176.9	65.3	-34.5	0	0	0	112.8	P264 K324	P264-D266 VanDerWaalsContact CB-OD1 3.28Å; P264-D266 WeakPolarHBondContact CB-OD1 3.24Å; P264-D266 WeakPolarHBondContact CG-OD1 3.3Å; P264-D266 PolarHBondContact O-N 2.97Å; P264-D266 VanDerWaalsContact O-N 3.14Å; D266-K324 PolarHBondContact O-NZ 3.3Å
267	A	95	Very high	95.3	Very high	36 Å²	36	50.2 Å²	50.2	30%	0.298	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-38.4	177.3	0	0	0	0	0	111.9	P263 P264 D321 K324	P263-A267 HydrophobicContact CB-CB 4.31Å; P264-A267 HydrophobicContact CG-CB 3.65Å; P264-A267 WeakPolarHBondContact O-CB 3.49Å; P264-A267 PolarHBondContact O-N 3.38Å; A267-D321 VanDerWaalsContact O-CB 3.29Å; A267-D321 WeakPolarHBondContact O-CB 3.26Å; A267-K324 PolarHBondContact O-NZ 2.8Å
268	W	96.7	Very high	95.2	Very high	5 Å²	5	56.2 Å²	56.2	2%	0.019	29%	0.285	C	S	.	.			trans	-138.7	82	176.1	-169.3	4.7	0	0	0	112	P203 E204 L207 P263 P264 D265 D270 M271 M274 M320 D321	P203-W268 HydrophobicContact CB-CH2 4.13Å; P203-W268 HydrophobicContact CB-CZ3 4.07Å; P203-W268 HydrophobicContact CG-CH2 4.24Å; P203-W268 HydrophobicContact CG-CZ3 4.18Å; E204-W268 HydrophobicContact CB-CH2 4.16Å; E204-W268 HydrophobicContact CB-CZ2 3.97Å; L207-W268 HydrophobicContact CD1-CH2 3.68Å; L207-W268 HydrophobicContact CD1-CZ2 4.48Å; L207-W268 HydrophobicContact CD1-CZ3 3.97Å; P263-W268 HydrophobicContact CB-CB 4.2Å; P263-W268 HydrophobicContact CG-CE3 4.25Å; P264-W268 PolarHBondContact O-N 3.43Å; D265-W268 CarbonylContact O-C 3.32Å; W268-D270 VanDerWaalsContact C-N 3.29Å; W268-D270 PolarHBondContact O-N 3.13Å; W268-M271 HydrophobicContact CB-CB 4.18Å; W268-M271 HydrophobicContact CD2-CB 3.62Å; W268-M271 HydrophobicContact CD2-CG 3.98Å; W268-M271 HydrophobicContact CD2-SD 4.42Å; W268-M271 HydrophobicContact CE3-CB 4.01Å; W268-M271 HydrophobicContact CE3-CG 3.86Å; W268-M271 HydrophobicContact CE3-SD 3.82Å; W268-M271 HydrophobicContact CG-CB 3.68Å; W268-M271 HydrophobicContact CZ3-CG 4.19Å; W268-M271 HydrophobicContact CZ3-SD 4.22Å; W268-M271 WeakPolarHBondContact O-CB 3.32Å; W268-M271 PolarHBondContact O-N 3.13Å; W268-M274 HydrophobicContact CZ2-CG 4.14Å; W268-M274 HydrophobicContact CZ2-SD 4.25Å; W268-M320 HydrophobicContact CE3-CB 3.96Å; W268-M320 HydrophobicContact CZ3-CB 4.33Å; W268-D321 HydrophobicContact CB-CB 3.94Å; W268-D321 HydrophobicContact CG-CB 3.83Å
269	V	94.8	Very high	95.1	Very high	90 Å²	90	52.7 Å²	52.7	55%	0.545	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-59.6	-40.2	-174.2	178.9	0	0	0	0	111.9	D265 M271	D265-V269 WeakPolarHBondContact O-CA 3.28Å; D265-V269 PolarHBondContact O-N 3.44Å; V269-M271 VanDerWaalsContact C-N 3.34Å; V269-M271 PolarHBondContact O-N 2.86Å
270	D	95.2	Very high	94.9	Very high	61 Å²	61	52.6 Å²	52.6	33%	0.326	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-87.9	4.1	-175.9	-71.5	-25.4	0	0	0	114.1	W268 K272 K273	W268-D270 VanDerWaalsContact C-N 3.29Å; W268-D270 PolarHBondContact O-N 3.13Å; D270-K272 PolarHBondContact O-N 2.93Å; D270-K273 HydrophobicContact CB-CD 4.24Å; D270-K273 WeakPolarHBondContact O-CB 3.24Å; D270-K273 PolarHBondContact O-N 3.12Å; D270-K273 WeakPolarHBondContact OD1-CD 3.39Å; D270-K273 WeakPolarHBondContact OD1-CE 2.96Å; D270-K273 IonicContact OD1-NZ 3.67Å; D270-K273 PolarHBondContact OD1-NZ 3.04Å
271	M	95.8	Very high	94.7	Very high	3 Å²	3	55 Å²	55	2%	0.015	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-56	-36.7	176.2	-171.4	175.7	56.5	0	0	111.5	L207 Y262 P263 W268 V269 K273 M274 Y277	L207-M271 HydrophobicContact CD1-CG 4.22Å; Y262-M271 HydrophobicContact CE1-CE 3.75Å; Y262-M271 WeakPolarHBondContact OH-CE 3.32Å; P263-M271 HydrophobicContact CG-CE 3.89Å; P263-M271 HydrophobicContact CG-SD 3.61Å; W268-M271 HydrophobicContact CB-CB 4.18Å; W268-M271 HydrophobicContact CD2-CB 3.62Å; W268-M271 HydrophobicContact CD2-CG 3.98Å; W268-M271 HydrophobicContact CD2-SD 4.42Å; W268-M271 HydrophobicContact CE3-CB 4.01Å; W268-M271 HydrophobicContact CE3-CG 3.86Å; W268-M271 HydrophobicContact CE3-SD 3.82Å; W268-M271 HydrophobicContact CG-CB 3.68Å; W268-M271 HydrophobicContact CZ3-CG 4.19Å; W268-M271 HydrophobicContact CZ3-SD 4.22Å; W268-M271 WeakPolarHBondContact O-CB 3.32Å; W268-M271 PolarHBondContact O-N 3.13Å; V269-M271 VanDerWaalsContact C-N 3.34Å; V269-M271 PolarHBondContact O-N 2.86Å; M271-K273 PolarHBondContact O-N 3.45Å; M271-M274 VanDerWaalsContact O-CB 3.32Å; M271-M274 WeakPolarHBondContact O-CB 3.44Å; M271-M274 VanDerWaalsContact O-CG 3.29Å; M271-M274 WeakPolarHBondContact O-CG 3.22Å; M271-M274 PolarHBondContact O-N 3.4Å; M271-M274 VanDerWaalsContact O-N 3.16Å; M271-Y277 HydrophobicContact CE-CE2 3.96Å; M271-Y277 HydrophobicContact CG-CD2 4.03Å; M271-Y277 HydrophobicContact CG-CE2 4.19Å; M271-Y277 WeakPolarHBondContact O-CD2 3.26Å
272	K	94.8	Very high	94.6	Very high	104 Å²	104	62.9 Å²	62.9	45%	0.452	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-66.8	-17.1	179.1	-60.3	179.4	-176.6	170.6	0	113.4	D265 D270 Y277	D265-K272 IonicContact OD1-NZ 2.75Å; D265-K272 IonicContact OD2-NZ 2.85Å; D265-K272 PolarHBondContact OD2-NZ 2.92Å; D270-K272 PolarHBondContact O-N 2.93Å; K272-Y277 HydrophobicContact CB-CD1 4.24Å; K272-Y277 HydrophobicContact CB-CE1 4.01Å; K272-Y277 HydrophobicContact CG-CD1 4.49Å; K272-Y277 HydrophobicContact CG-CE1 3.81Å; K272-Y277 HydrophobicContact CG-CE2 4.35Å
273	K	94.9	Very high	94.5	Very high	157 Å²	157	63.7 Å²	63.7	68%	0.683	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-92.3	-6.3	178.4	-58.3	178.3	-177.2	163	0	112.7	D270 M271	D270-K273 HydrophobicContact CB-CD 4.24Å; D270-K273 WeakPolarHBondContact O-CB 3.24Å; D270-K273 PolarHBondContact O-N 3.12Å; D270-K273 WeakPolarHBondContact OD1-CD 3.39Å; D270-K273 WeakPolarHBondContact OD1-CE 2.96Å; D270-K273 IonicContact OD1-NZ 3.67Å; D270-K273 PolarHBondContact OD1-NZ 3.04Å; M271-K273 PolarHBondContact O-N 3.45Å
274	M	94.1	Very high	94.4	Very high	27 Å²	27	67.7 Å²	67.7	13%	0.133	35%	0.349	C	S	.	.	S	Bend	trans	-67.5	137.3	179.9	-63.5	-58.1	-60.7	0	0	110.7	E204 L207 A209 W268 M271 D276 Y277	E204-M274 HydrophobicContact CB-CE 3.9Å; E204-M274 WeakPolarHBondContact O-CE 3.34Å; L207-M274 HydrophobicContact CB-CB 3.82Å; L207-M274 HydrophobicContact CB-CE 3.85Å; L207-M274 HydrophobicContact CB-CG 4.13Å; L207-M274 HydrophobicContact CD1-CG 4.32Å; A209-M274 HydrophobicContact CB-CE 3.83Å; W268-M274 HydrophobicContact CZ2-CG 4.14Å; W268-M274 HydrophobicContact CZ2-SD 4.25Å; M271-M274 VanDerWaalsContact O-CB 3.32Å; M271-M274 WeakPolarHBondContact O-CB 3.44Å; M271-M274 VanDerWaalsContact O-CG 3.29Å; M271-M274 WeakPolarHBondContact O-CG 3.22Å; M271-M274 PolarHBondContact O-N 3.4Å; M271-M274 VanDerWaalsContact O-N 3.16Å; M274-D276 VanDerWaalsContact C-N 3.26Å; M274-D276 PolarHBondContact O-N 3.48Å; M274-D276 VanDerWaalsContact O-N 3.16Å; M274-Y277 VanDerWaalsContact O-CB 3.24Å; M274-Y277 WeakPolarHBondContact O-CB 3.4Å; M274-Y277 PolarHBondContact O-N 3.48Å
275	P	93.4	Very high	94.4	Very high	64 Å²	64	65.3 Å²	65.3	42%	0.416	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-39.3	-175.6	-33.6	41.3	0	0	0	114.7	L207 G208	L207-P275 WeakPolarHBondContact O-CD 3.28Å; G208-P275 VanDerWaalsContact O-CG 3.27Å; G208-P275 WeakPolarHBondContact O-CG 3.26Å
276	D	93.3	Very high	94.5	Very high	40 Å²	40	62.6 Å²	62.6	21%	0.214	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	15.3	-178.2	-60.6	-42.5	0	0	0	113.5	L207 G208 Y248 M274 H278 Q279 L280	L207-D276 PolarHBondContact O-N 2.88Å; L207-D276 VanDerWaalsContact O-N 3.08Å; G208-D276 WeakPolarHBondContact CA-OD2 3.42Å; Y248-D276 HydrophobicContact CD2-CB 3.67Å; Y248-D276 HydrophobicContact CE2-CB 4.46Å; Y248-D276 HydrophobicContact CG-CB 4.34Å; M274-D276 VanDerWaalsContact C-N 3.26Å; M274-D276 PolarHBondContact O-N 3.48Å; M274-D276 VanDerWaalsContact O-N 3.16Å; D276-H278 VanDerWaalsContact C-N 3.27Å; D276-H278 PolarHBondContact O-N 3.39Å; D276-Q279 HydrophobicContact CB-CB 4.43Å; D276-Q279 WeakPolarHBondContact O-CB 3.39Å; D276-Q279 PolarHBondContact O-N 2.86Å; D276-L280 PolarHBondContact O-N 3.1Å; D276-L280 VanDerWaalsContact O-N 3.11Å
277	Y	95.2	Very high	94.5	Very high	27 Å²	27	63.5 Å²	63.5	11%	0.106	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-39.7	176.1	-180	-111.7	0	0	0	112.3	M271 K272 M274 Q279 L280 L281	M271-Y277 HydrophobicContact CE-CE2 3.96Å; M271-Y277 HydrophobicContact CG-CD2 4.03Å; M271-Y277 HydrophobicContact CG-CE2 4.19Å; M271-Y277 WeakPolarHBondContact O-CD2 3.26Å; K272-Y277 HydrophobicContact CB-CD1 4.24Å; K272-Y277 HydrophobicContact CB-CE1 4.01Å; K272-Y277 HydrophobicContact CG-CD1 4.49Å; K272-Y277 HydrophobicContact CG-CE1 3.81Å; K272-Y277 HydrophobicContact CG-CE2 4.35Å; M274-Y277 VanDerWaalsContact O-CB 3.24Å; M274-Y277 WeakPolarHBondContact O-CB 3.4Å; M274-Y277 PolarHBondContact O-N 3.48Å; Y277-Q279 VanDerWaalsContact C-N 3.29Å; Y277-Q279 PolarHBondContact O-N 3.25Å; Y277-L280 HydrophobicContact CD2-CD2 4.46Å; Y277-L280 HydrophobicContact CE2-CD2 4.3Å; Y277-L280 WeakPolarHBondContact O-CB 3.33Å; Y277-L280 PolarHBondContact O-N 2.99Å; Y277-L281 HydrophobicContact CD1-CD1 4.17Å; Y277-L281 HydrophobicContact CE1-CD1 3.62Å; Y277-L281 HydrophobicContact CE1-CD2 4.5Å; Y277-L281 HydrophobicContact CE1-CG 4.11Å; Y277-L281 HydrophobicContact CE2-CD2 4.47Å; Y277-L281 PolarHBondContact O-N 3.48Å; Y277-L281 VanDerWaalsContact O-N 3.12Å
278	H	94.7	Very high	94.4	Very high	125 Å²	125	71.3 Å²	71.3	58%	0.579	35%	0.347	S	S	*	.	H	α-helix	trans	-64.8	-32.5	176.5	-66.9	-61.1	0	0	0	112.8	D276 L281 R282	D276-H278 VanDerWaalsContact C-N 3.27Å; D276-H278 PolarHBondContact O-N 3.39Å; H278-L281 PolarHBondContact O-N 3.08Å; H278-R282 WeakPolarHBondContact O-CG 3.28Å; H278-R282 PolarHBondContact O-N 3.36Å
279	Q	94.3	Very high	94.3	Very high	52 Å²	52	74.1 Å²	74.1	24%	0.243	37%	0.365	C	S	.	.	H	α-helix	trans	-68.2	-43.3	174.9	-176.6	60.4	47.3	0	0	110.6	Y248 D276 Y277 L281 R282 D283	Y248-Q279 HydrophobicContact CD1-CG 3.66Å; Y248-Q279 HydrophobicContact CD2-CB 4.29Å; Y248-Q279 HydrophobicContact CD2-CG 4.14Å; Y248-Q279 HydrophobicContact CE1-CB 4.46Å; Y248-Q279 HydrophobicContact CE1-CG 3.44Å; Y248-Q279 VanDerWaalsContact CE1-CG 3.44Å; Y248-Q279 HydrophobicContact CE2-CB 4.1Å; Y248-Q279 HydrophobicContact CE2-CG 3.94Å; Y248-Q279 HydrophobicContact CG-CG 4.01Å; D276-Q279 HydrophobicContact CB-CB 4.43Å; D276-Q279 WeakPolarHBondContact O-CB 3.39Å; D276-Q279 PolarHBondContact O-N 2.86Å; Y277-Q279 VanDerWaalsContact C-N 3.29Å; Y277-Q279 PolarHBondContact O-N 3.25Å; Q279-L281 VanDerWaalsContact C-N 3.25Å; Q279-L281 PolarHBondContact O-N 3.2Å; Q279-R282 WeakPolarHBondContact O-CB 3.18Å; Q279-R282 PolarHBondContact O-N 3.26Å; Q279-R282 VanDerWaalsContact OE1-CZ 3.27Å; Q279-D283 PolarHBondContact NE2-OD2 2.79Å; Q279-D283 PolarHBondContact O-N 3.5Å
280	L	94.2	Very high	94.4	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-54.4	-41.1	173.3	178	150.9	0	0	0	112.4	L207 Y248 F257 Y262 D276 Y277 D283 I285	L207-L280 HydrophobicContact CD1-CD1 4.46Å; L207-L280 HydrophobicContact CD2-CB 4.14Å; L207-L280 HydrophobicContact CD2-CD1 3.68Å; Y248-L280 HydrophobicContact CE2-CB 4.23Å; Y248-L280 WeakPolarHBondContact OH-CA 3.48Å; F257-L280 HydrophobicContact CE2-CD1 3.65Å; F257-L280 HydrophobicContact CZ-CD1 3.79Å; Y262-L280 HydrophobicContact CE2-CD2 4.06Å; D276-L280 PolarHBondContact O-N 3.1Å; D276-L280 VanDerWaalsContact O-N 3.11Å; Y277-L280 HydrophobicContact CD2-CD2 4.46Å; Y277-L280 HydrophobicContact CE2-CD2 4.3Å; Y277-L280 WeakPolarHBondContact O-CB 3.33Å; Y277-L280 PolarHBondContact O-N 2.99Å; L280-D283 PolarHBondContact O-N 3.44Å; L280-I285 HydrophobicContact CD1-CG2 4.23Å; L280-I285 HydrophobicContact CD2-CB 4.29Å; L280-I285 HydrophobicContact CD2-CG2 4.3Å; L280-I285 WeakPolarHBondContact CD2-O 3.14Å; L280-I285 HydrophobicContact CG-CB 3.97Å; L280-I285 HydrophobicContact CG-CG2 3.99Å; L280-I285 PolarHBondContact O-N 3.19Å
281	L	93.7	Very high	94.3	Very high	78 Å²	78	69.8 Å²	69.8	41%	0.408	35%	0.349	S	S	.	.	H	α-helix	trans	-67.9	-41.7	174.6	-65.1	-179.6	0	0	0	112.8	Y277 H278 Q279 D283 S284	Y277-L281 HydrophobicContact CD1-CD1 4.17Å; Y277-L281 HydrophobicContact CE1-CD1 3.62Å; Y277-L281 HydrophobicContact CE1-CD2 4.5Å; Y277-L281 HydrophobicContact CE1-CG 4.11Å; Y277-L281 HydrophobicContact CE2-CD2 4.47Å; Y277-L281 PolarHBondContact O-N 3.48Å; Y277-L281 VanDerWaalsContact O-N 3.12Å; H278-L281 PolarHBondContact O-N 3.08Å; Q279-L281 VanDerWaalsContact C-N 3.25Å; Q279-L281 PolarHBondContact O-N 3.2Å; L281-D283 PolarHBondContact O-N 2.92Å; L281-S284 PolarHBondContact O-N 3.46Å
282	R	95	Very high	94.3	Very high	170 Å²	170	77.5 Å²	77.5	64%	0.642	38%	0.383	S	S	*	.	H	α-helix	trans	-59.2	-37.7	175.7	-76.5	-168.2	-69.7	-107.5	5.1	111.9	H278 Q279 S284	H278-R282 WeakPolarHBondContact O-CG 3.28Å; H278-R282 PolarHBondContact O-N 3.36Å; Q279-R282 WeakPolarHBondContact O-CB 3.18Å; Q279-R282 PolarHBondContact O-N 3.26Å; Q279-R282 VanDerWaalsContact OE1-CZ 3.27Å; R282-S284 PolarHBondContact O-N 2.84Å
283	D	94.5	Very high	94.4	Very high	37 Å²	37	76 Å²	76	20%	0.198	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	6.8	177.6	-80.4	-52.9	0	0	0	114.2	Y248 K250 Q279 L280 L281 I285	Y248-D283 WeakPolarHBondContact CE1-OD2 3.33Å; Y248-D283 PolarHBondContact OH-OD2 3.01Å; K250-D283 HydrophobicContact CD-CB 4.27Å; K250-D283 WeakPolarHBondContact CE-OD1 3.48Å; K250-D283 IonicContact NZ-OD1 3.44Å; K250-D283 PolarHBondContact NZ-OD1 3.02Å; Q279-D283 PolarHBondContact NE2-OD2 2.79Å; Q279-D283 PolarHBondContact O-N 3.5Å; L280-D283 PolarHBondContact O-N 3.44Å; L281-D283 PolarHBondContact O-N 2.92Å; D283-I285 HydrophobicContact CB-CD1 4.3Å; D283-I285 HydrophobicContact CB-CG1 4.27Å; D283-I285 PolarHBondContact O-N 3.36Å
284	S	93.2	Very high	94.5	Very high	86 Å²	86	70.6 Å²	70.6	60%	0.601	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	23.4	178.4	-57.7	0	0	0	0	114.3	L281 R282 S286 T289	L281-S284 PolarHBondContact O-N 3.46Å; R282-S284 PolarHBondContact O-N 2.84Å; S284-S286 PolarHBondContact O-N 3.44Å; S284-T289 PolarHBondContact O-OG1 2.86Å
285	I	94	Very high	94.7	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.005	35%	0.352	C	S	.	.			trans	-81.3	105.7	172.4	-61.4	175.8	0	0	0	107.7	K250 L253 E254 F257 Y262 L280 D283 Y290	K250-I285 HydrophobicContact CG-CD1 4.31Å; L253-I285 HydrophobicContact CB-CD1 4.48Å; E254-I285 HydrophobicContact CG-CD1 3.61Å; E254-I285 HydrophobicContact CG-CG1 4.03Å; F257-I285 HydrophobicContact CD2-CG2 3.31Å; F257-I285 HydrophobicContact CE2-CG2 3.5Å; F257-I285 HydrophobicContact CG-CG2 4.29Å; Y262-I285 HydrophobicContact CD2-CG2 4.47Å; Y262-I285 HydrophobicContact CE2-CG2 4.31Å; L280-I285 HydrophobicContact CD1-CG2 4.23Å; L280-I285 HydrophobicContact CD2-CB 4.29Å; L280-I285 HydrophobicContact CD2-CG2 4.3Å; L280-I285 WeakPolarHBondContact CD2-O 3.14Å; L280-I285 HydrophobicContact CG-CB 3.97Å; L280-I285 HydrophobicContact CG-CG2 3.99Å; L280-I285 PolarHBondContact O-N 3.19Å; D283-I285 HydrophobicContact CB-CD1 4.3Å; D283-I285 HydrophobicContact CB-CG1 4.27Å; D283-I285 PolarHBondContact O-N 3.36Å; I285-Y290 HydrophobicContact CB-CE2 4.17Å; I285-Y290 HydrophobicContact CG1-CE2 4.18Å; I285-Y290 HydrophobicContact CG2-CD2 3.98Å; I285-Y290 HydrophobicContact CG2-CE2 3.81Å
286	S	93.9	Very high	94.8	Very high	36 Å²	36	69.2 Å²	69.2	25%	0.252	35%	0.345	S	S	.	.	S	Bend	trans	-144.7	168.2	-171.1	72.7	0	0	0	0	112.8	Y262 S284 K288 T289 Y290	Y262-S286 VanDerWaalsContact CD2-C 3.46Å; S284-S286 PolarHBondContact O-N 3.44Å; S286-K288 PolarHBondContact O-N 3.4Å; S286-K288 PolarHBondContact OG-N 3.08Å; S286-T289 PolarHBondContact O-N 3.07Å; S286-T289 PolarHBondContact OG-N 2.86Å; S286-T289 PolarHBondContact OG-OG1 2.87Å; S286-Y290 PolarHBondContact O-N 3.18Å
287	K	93.5	Very high	94.9	Very high	134 Å²	134	68.5 Å²	68.5	58%	0.583	35%	0.346	S	S	*	.	H	α-helix	trans	-53.9	-34.9	170.3	-172.3	176.2	-179.5	177.1	0	112.8	Y262 T289 G291	Y262-K287 HydrophobicContact CD1-CB 3.74Å; Y262-K287 HydrophobicContact CD1-CG 4.49Å; Y262-K287 HydrophobicContact CE1-CB 4.26Å; Y262-K287 HydrophobicContact CG-CB 4.27Å; K287-T289 VanDerWaalsContact C-N 3.32Å; K287-T289 PolarHBondContact O-N 3.19Å; K287-G291 VanDerWaalsContact O-CA 3.23Å; K287-G291 WeakPolarHBondContact O-CA 3.32Å; K287-G291 PolarHBondContact O-N 3.5Å
288	K	93.9	Very high	95	Very high	201 Å²	201	67.8 Å²	67.8	87%	0.874	34%	0.344	S	S	*	.	H	α-helix	trans	-64.2	-39	177.9	-175.3	-179.5	177.4	-177.4	0	111.8	S286	S286-K288 PolarHBondContact O-N 3.4Å; S286-K288 PolarHBondContact OG-N 3.08Å
289	T	94.7	Very high	95	Very high	63 Å²	63	62 Å²	62	39%	0.387	32%	0.317	S	S	.	.	H	α-helix	trans	-79.4	-41.8	-176.5	-47.3	0	0	0	0	111.7	S284 S286 K287	S284-T289 PolarHBondContact O-OG1 2.86Å; S286-T289 PolarHBondContact O-N 3.07Å; S286-T289 PolarHBondContact OG-N 2.86Å; S286-T289 PolarHBondContact OG-OG1 2.87Å; K287-T289 VanDerWaalsContact C-N 3.32Å; K287-T289 PolarHBondContact O-N 3.19Å
290	Y	96.7	Very high	95.1	Very high	13 Å²	13	66.5 Å²	66.5	5%	0.051	34%	0.338	C	S	.	.	H	α-helix	trans	-117.5	2.3	-168	-60.7	-75.8	0	0	0	115	E254 F257 R258 G261 Y262 I285 S286 K292 Y293	E254-Y290 WeakPolarHBondContact CG-OH 3.48Å; F257-Y290 HydrophobicContact CB-CD1 4.03Å; F257-Y290 HydrophobicContact CB-CD2 4.08Å; F257-Y290 HydrophobicContact CB-CG 3.75Å; R258-Y290 HydrophobicContact CG-CD1 3.93Å; R258-Y290 HydrophobicContact CG-CE1 3.56Å; G261-Y290 WeakPolarHBondContact CA-O 3.45Å; Y262-Y290 PolarHBondContact N-O 3.28Å; I285-Y290 HydrophobicContact CB-CE2 4.17Å; I285-Y290 HydrophobicContact CG1-CE2 4.18Å; I285-Y290 HydrophobicContact CG2-CD2 3.98Å; I285-Y290 HydrophobicContact CG2-CE2 3.81Å; S286-Y290 PolarHBondContact O-N 3.18Å; Y290-K292 PolarHBondContact O-N 3.08Å; Y290-K292 VanDerWaalsContact O-N 3.16Å; Y290-Y293 HydrophobicContact CD1-CD2 4.01Å; Y290-Y293 AromaticContact CD1-CE2 3.94Å; Y290-Y293 HydrophobicContact CD1-CE2 3.94Å; Y290-Y293 PolarHBondContact O-N 2.86Å
291	G	93.3	Very high	95	Very high	48 Å²	48	73.5 Å²	73.5	50%	0.495	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-9	-177.4	0	0	0	0	0	115.6	K287	K287-G291 VanDerWaalsContact O-CA 3.23Å; K287-G291 WeakPolarHBondContact O-CA 3.32Å; K287-G291 PolarHBondContact O-N 3.5Å
292	K	95	Very high	94.9	Very high	164 Å²	164	74.1 Å²	74.1	71%	0.713	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-12.4	175.8	68.1	177.6	-179.8	178.1	0	114.1	Y290	Y290-K292 PolarHBondContact O-N 3.08Å; Y290-K292 VanDerWaalsContact O-N 3.16Å
293	Y	97.5	Very high	94.8	Very high	72 Å²	72	75.4 Å²	75.4	28%	0.282	38%	0.38	S	S	.	.			trans	-91.4	152.7	-177.9	-61.6	-81.1	0	0	0	110.3	R258 G261 Y290	R258-Y293 WeakPolarHBondContact O-CB 3.16Å; R258-Y293 WeakPolarHBondContact O-CD1 3.39Å; R258-Y293 VanDerWaalsContact O-CG 3.27Å; G261-Y293 WeakPolarHBondContact CA-O 3.49Å; Y290-Y293 HydrophobicContact CD1-CD2 4.01Å; Y290-Y293 AromaticContact CD1-CE2 3.94Å; Y290-Y293 HydrophobicContact CD1-CE2 3.94Å; Y290-Y293 PolarHBondContact O-N 2.86Å
294	S	97.1	Very high	94.6	Very high	45 Å²	45	76.4 Å²	76.4	32%	0.315	38%	0.383	S	S	.	.			trans	-155.2	161.3	173.7	65.9	0	0	0	0	109.4	V259 E296 G297 Y298	V259-S294 CarbonylContact O-C 3.54Å; S294-E296 WeakPolarHBondContact CB-OE2 3.28Å; S294-E296 PolarHBondContact O-N 3.25Å; S294-G297 PolarHBondContact O-N 2.89Å; S294-G297 VanDerWaalsContact O-N 3.12Å; S294-G297 PolarHBondContact OG-N 3Å; S294-G297 VanDerWaalsContact OG-N 3.09Å; S294-Y298 PolarHBondContact O-N 3.49Å
295	L	97.2	Very high	94.6	Very high	5 Å²	5	82 Å²	82	3%	0.026	40%	0.396	C	S	.	.	H	α-helix	trans	-59.1	-38.4	178	179.1	61	0	0	0	111.3	I234 V259 M260 Y298 F299 L311 L314 R315	I234-L295 HydrophobicContact CD1-CD1 3.74Å; V259-L295 HydrophobicContact CG1-CD1 4.28Å; V259-L295 WeakPolarHBondContact O-CA 3.31Å; V259-L295 PolarHBondContact O-N 2.92Å; V259-L295 VanDerWaalsContact O-N 3.15Å; M260-L295 HydrophobicContact CE-CB 4.23Å; M260-L295 HydrophobicContact CE-CD2 4.3Å; M260-L295 HydrophobicContact SD-CB 4.17Å; M260-L295 HydrophobicContact SD-CD1 3.97Å; M260-L295 HydrophobicContact SD-CG 4.46Å; L295-Y298 WeakPolarHBondContact O-CB 3.5Å; L295-Y298 PolarHBondContact O-N 2.87Å; L295-F299 HydrophobicContact CD1-CD2 4.35Å; L295-F299 HydrophobicContact CD1-CE2 3.75Å; L295-F299 HydrophobicContact CG-CD2 4.33Å; L295-F299 HydrophobicContact CG-CE2 3.92Å; L295-F299 WeakPolarHBondContact O-CD2 3.35Å; L295-F299 PolarHBondContact O-N 2.83Å; L295-L311 HydrophobicContact CD2-CD1 4.09Å; L295-L311 HydrophobicContact CG-CD1 4.23Å; L295-L314 HydrophobicContact CD1-CD2 4.43Å; L295-L314 HydrophobicContact CD2-CD2 4.17Å; L295-L314 HydrophobicContact CD2-CG 4.11Å; L295-R315 HydrophobicContact CD2-CB 4.5Å
296	E	95.9	Very high	94.6	Very high	57 Å²	57	83.1 Å²	83.1	27%	0.266	40%	0.403	S	S	.	.	H	α-helix	trans	-62.4	-47.6	174.6	-62.7	78.6	-172.7	0	0	111.2	S294 Y298 F299 E300 L311 R315	S294-E296 WeakPolarHBondContact CB-OE2 3.28Å; S294-E296 PolarHBondContact O-N 3.25Å; E296-Y298 PolarHBondContact O-N 2.91Å; E296-F299 PolarHBondContact O-N 2.96Å; E296-F299 VanDerWaalsContact O-N 3.08Å; E296-E300 WeakPolarHBondContact O-CG 3.43Å; E296-E300 PolarHBondContact O-N 3.35Å; E296-L311 HydrophobicContact CG-CD2 4.01Å; E296-R315 IonicContact OE1-CZ 2.94Å; E296-R315 IonicContact OE1-NE 3.13Å; E296-R315 PolarHBondContact OE1-NE 3.13Å; E296-R315 IonicContact OE1-NH2 2.69Å; E296-R315 PolarHBondContact OE1-NH2 3Å
297	G	96	Very high	94.6	Very high	24 Å²	24	84.4 Å²	84.4	25%	0.247	41%	0.407	C	S	.	.	H	α-helix	trans	-60.1	-32.8	177.4	0	0	0	0	0	112.8	S294 E300 E301	S294-G297 PolarHBondContact O-N 2.89Å; S294-G297 VanDerWaalsContact O-N 3.12Å; S294-G297 PolarHBondContact OG-N 3Å; S294-G297 VanDerWaalsContact OG-N 3.09Å; G297-E300 PolarHBondContact O-N 3.12Å; G297-E301 WeakPolarHBondContact O-CB 3.33Å; G297-E301 PolarHBondContact O-N 2.98Å
298	Y	96.4	Very high	94.7	Very high	12 Å²	12	83.9 Å²	83.9	5%	0.047	41%	0.407	C	S	.	.	H	α-helix	trans	-63.4	-45.6	173	170.2	-101.5	0	0	0	112.5	I234 V259 S294 L295 E296 E301 K302	I234-Y298 HydrophobicContact CD1-CE1 4.46Å; I234-Y298 HydrophobicContact CG1-CE1 4.15Å; V259-Y298 HydrophobicContact CG1-CD1 4.26Å; V259-Y298 HydrophobicContact CG1-CD2 4.28Å; V259-Y298 HydrophobicContact CG1-CG 3.93Å; V259-Y298 HydrophobicContact CG2-CD2 3.98Å; V259-Y298 HydrophobicContact CG2-CE2 4.28Å; V259-Y298 HydrophobicContact CG2-CG 4.46Å; S294-Y298 PolarHBondContact O-N 3.49Å; L295-Y298 WeakPolarHBondContact O-CB 3.5Å; L295-Y298 PolarHBondContact O-N 2.87Å; E296-Y298 PolarHBondContact O-N 2.91Å; Y298-E301 PolarHBondContact O-N 2.78Å; Y298-K302 HydrophobicContact CD2-CG 4.43Å; Y298-K302 HydrophobicContact CE1-CG 4.43Å; Y298-K302 HydrophobicContact CE2-CG 4Å; Y298-K302 WeakPolarHBondContact O-CB 3.39Å; Y298-K302 WeakPolarHBondContact O-CG 3.38Å; Y298-K302 PolarHBondContact O-N 2.85Å; Y298-K302 VanDerWaalsContact O-N 3.08Å
299	F	96	Very high	94.8	Very high	4 Å²	4	78.1 Å²	78.1	2%	0.018	38%	0.38	C	S	.	.	H	α-helix	trans	-67.4	-37.9	177.5	-74.1	-66.9	0	0	0	112.2	T230 L295 E296 K302 K303 F304 V306 L311 L314	T230-F299 HydrophobicContact CG2-CD1 4.25Å; T230-F299 HydrophobicContact CG2-CE1 3.6Å; L295-F299 HydrophobicContact CD1-CD2 4.35Å; L295-F299 HydrophobicContact CD1-CE2 3.75Å; L295-F299 HydrophobicContact CG-CD2 4.33Å; L295-F299 HydrophobicContact CG-CE2 3.92Å; L295-F299 WeakPolarHBondContact O-CD2 3.35Å; L295-F299 PolarHBondContact O-N 2.83Å; E296-F299 PolarHBondContact O-N 2.96Å; E296-F299 VanDerWaalsContact O-N 3.08Å; F299-K302 CarbonylContact O-C 3.59Å; F299-K302 PolarHBondContact O-N 3.21Å; F299-K303 PolarHBondContact O-N 2.81Å; F299-K303 VanDerWaalsContact O-N 3.1Å; F299-F304 HydrophobicContact CD1-CB 4.29Å; F299-F304 AromaticContact CD1-CD1 3.7Å; F299-F304 HydrophobicContact CD1-CD1 3.7Å; F299-F304 HydrophobicContact CD1-CG 4.38Å; F299-F304 HydrophobicContact CE1-CD1 4Å; F299-F304 HydrophobicContact CE1-CE1 4.47Å; F299-F304 PolarHBondContact O-N 3.32Å; F299-V306 HydrophobicContact CD2-CG1 4.22Å; F299-V306 HydrophobicContact CG-CG1 4.25Å; F299-L311 HydrophobicContact CD2-CD1 4.14Å; F299-L311 HydrophobicContact CE2-CD1 4.01Å; F299-L314 HydrophobicContact CE2-CD2 3.81Å; F299-L314 HydrophobicContact CZ-CD2 3.63Å
300	E	94.7	Very high	94.8	Very high	147 Å²	147	77 Å²	77	69%	0.687	37%	0.37	S	S	*	.	H	α-helix	trans	-61.7	-47.9	173.8	-71.3	175.7	-176.1	0	0	111.9	E296 G297 K302 K303	E296-E300 WeakPolarHBondContact O-CG 3.43Å; E296-E300 PolarHBondContact O-N 3.35Å; G297-E300 PolarHBondContact O-N 3.12Å; E300-K302 VanDerWaalsContact C-N 3.26Å; E300-K302 PolarHBondContact O-N 3.47Å; E300-K303 PolarHBondContact O-N 2.88Å
301	E	93.2	Very high	94.9	Very high	147 Å²	147	77 Å²	77	69%	0.687	37%	0.371	S	S	*	.	H	α-helix	trans	-58.1	-41	176.3	-174.5	-174	152.3	0	0	111.2	G297 Y298 K303	G297-E301 WeakPolarHBondContact O-CB 3.33Å; G297-E301 PolarHBondContact O-N 2.98Å; Y298-E301 PolarHBondContact O-N 2.78Å; E301-K303 PolarHBondContact O-N 2.92Å
302	K	91.2	Very high	95.1	Very high	91 Å²	91	76 Å²	76	40%	0.396	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-4.8	177.1	-71.8	-75.7	-178.3	168.9	0	113.9	E232 Y298 F299 E300 F304	E232-K302 IonicContact OE2-NZ 3.74Å; E232-K302 PolarHBondContact OE2-NZ 2.87Å; Y298-K302 HydrophobicContact CD2-CG 4.43Å; Y298-K302 HydrophobicContact CE1-CG 4.43Å; Y298-K302 HydrophobicContact CE2-CG 4Å; Y298-K302 WeakPolarHBondContact O-CB 3.39Å; Y298-K302 WeakPolarHBondContact O-CG 3.38Å; Y298-K302 PolarHBondContact O-N 2.85Å; Y298-K302 VanDerWaalsContact O-N 3.08Å; F299-K302 CarbonylContact O-C 3.59Å; F299-K302 PolarHBondContact O-N 3.21Å; E300-K302 VanDerWaalsContact C-N 3.26Å; E300-K302 PolarHBondContact O-N 3.47Å; K302-F304 HydrophobicContact CB-CB 4.29Å; K302-F304 PolarHBondContact O-N 3.43Å
303	K	92.7	Very high	95.2	Very high	197 Å²	197	68.1 Å²	68.1	86%	0.857	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	37	-173.3	-55.9	-178.5	-179.8	-179.7	0	111.9	F299 E300 E301	F299-K303 PolarHBondContact O-N 2.81Å; F299-K303 VanDerWaalsContact O-N 3.1Å; E300-K303 PolarHBondContact O-N 2.88Å; E301-K303 PolarHBondContact O-N 2.92Å
304	F	91.1	Very high	95.3	Very high	58 Å²	58	64.7 Å²	64.7	25%	0.254	31%	0.31	S	S	.	.			trans	-106	118.2	-179.2	-173.7	-91.5	0	0	0	109.6	L229 T230 F299 K302 V306	L229-F304 HydrophobicContact CB-CE1 4.33Å; L229-F304 HydrophobicContact CB-CZ 4.43Å; L229-F304 WeakPolarHBondContact O-CE2 3.48Å; L229-F304 WeakPolarHBondContact O-CZ 3.32Å; T230-F304 HydrophobicContact CG2-CD1 4.3Å; T230-F304 HydrophobicContact CG2-CE1 4.43Å; T230-F304 HydrophobicContact CG2-CG 4.45Å; F299-F304 HydrophobicContact CD1-CB 4.29Å; F299-F304 AromaticContact CD1-CD1 3.7Å; F299-F304 HydrophobicContact CD1-CD1 3.7Å; F299-F304 HydrophobicContact CD1-CG 4.38Å; F299-F304 HydrophobicContact CE1-CD1 4Å; F299-F304 HydrophobicContact CE1-CE1 4.47Å; F299-F304 PolarHBondContact O-N 3.32Å; K302-F304 HydrophobicContact CB-CB 4.29Å; K302-F304 PolarHBondContact O-N 3.43Å; F304-V306 HydrophobicContact CD1-CB 4.36Å; F304-V306 HydrophobicContact CE1-CB 4.27Å
305	K	93.3	Very high	95.3	Very high	202 Å²	202	67.2 Å²	67.2	88%	0.878	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-85.1	117.3	176.3	-172.8	-179.4	-179.3	-177.1	0	109.2
306	V	93.1	Very high	95.4	Very high	25 Å²	25	70.8 Å²	70.8	15%	0.152	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-103.4	142.7	175.8	60.5	0	0	0	0	109.7	L229 F299 F304 E310 L311	L229-V306 HydrophobicContact CD1-CG2 4.3Å; F299-V306 HydrophobicContact CD2-CG1 4.22Å; F299-V306 HydrophobicContact CG-CG1 4.25Å; F304-V306 HydrophobicContact CD1-CB 4.36Å; F304-V306 HydrophobicContact CE1-CB 4.27Å; V306-E310 HydrophobicContact CG2-CB 3.67Å; V306-L311 HydrophobicContact CG1-CB 3.96Å; V306-L311 HydrophobicContact CG1-CD1 4.34Å; V306-L311 HydrophobicContact CG1-CD2 4.18Å; V306-L311 HydrophobicContact CG1-CG 4.39Å; V306-L311 HydrophobicContact CG2-CB 4.14Å
307	D	94	Very high	95.5	Very high	64 Å²	64	68.1 Å²	68.1	34%	0.342	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.5	144.9	172.6	-178.6	-91.6	0	0	0	109.7	R309 E310 L311	D307-R309 PolarHBondContact O-N 3.46Å; D307-R309 VanDerWaalsContact OD1-CB 3.29Å; D307-R309 WeakPolarHBondContact OD1-CB 3.26Å; D307-R309 IonicContact OD1-CZ 2.65Å; D307-R309 PolarHBondContact OD1-N 2.86Å; D307-R309 IonicContact OD1-NE 2.89Å; D307-R309 PolarHBondContact OD1-NE 3.08Å; D307-R309 IonicContact OD1-NH2 3.77Å; D307-R309 IonicContact OD2-NH2 2.87Å; D307-R309 PolarHBondContact OD2-NH2 3.09Å; D307-E310 HydrophobicContact CB-CB 4.31Å; D307-E310 HydrophobicContact CB-CG 3.96Å; D307-E310 WeakPolarHBondContact CB-OE2 3.48Å; D307-E310 PolarHBondContact N-OE2 3.07Å; D307-E310 WeakPolarHBondContact O-CB 3.47Å; D307-E310 PolarHBondContact O-N 3.01Å; D307-E310 VanDerWaalsContact O-N 3.1Å; D307-L311 PolarHBondContact O-N 2.95Å
308	E	95.1	Very high	95.6	Very high	123 Å²	123	67 Å²	67	58%	0.575	30%	0.302	S	S	*	.	H	α-helix	trans	-60.1	-33.4	-176.4	-175.4	56.4	-145.7	0	0	112.1	A312	E308-A312 VanDerWaalsContact O-CB 3.22Å; E308-A312 WeakPolarHBondContact O-CB 3.3Å; E308-A312 PolarHBondContact O-N 2.87Å
309	R	95.8	Very high	95.7	Very high	80 Å²	80	68.1 Å²	68.1	30%	0.302	31%	0.31	S	S	.	.	H	α-helix	trans	-73	-36.6	178.2	-63.4	165.9	-69.5	-167	-4.2	111.8	D307 A312 L313 Y336 E339	D307-R309 PolarHBondContact O-N 3.46Å; D307-R309 VanDerWaalsContact OD1-CB 3.29Å; D307-R309 WeakPolarHBondContact OD1-CB 3.26Å; D307-R309 IonicContact OD1-CZ 2.65Å; D307-R309 PolarHBondContact OD1-N 2.86Å; D307-R309 IonicContact OD1-NE 2.89Å; D307-R309 PolarHBondContact OD1-NE 3.08Å; D307-R309 IonicContact OD1-NH2 3.77Å; D307-R309 IonicContact OD2-NH2 2.87Å; D307-R309 PolarHBondContact OD2-NH2 3.09Å; R309-A312 PolarHBondContact O-N 3.08Å; R309-L313 PolarHBondContact O-N 2.95Å; R309-Y336 HydrophobicContact CB-CD2 4.11Å; R309-E339 IonicContact NH1-OE2 3.21Å
310	E	96.7	Very high	95.8	Very high	40 Å²	40	69.1 Å²	69.1	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-47.5	173.7	-67.9	172.2	155.3	0	0	110.4	F225 L229 V306 D307 L314 Y336	F225-E310 HydrophobicContact CZ-CB 4.13Å; F225-E310 HydrophobicContact CZ-CG 4.26Å; L229-E310 HydrophobicContact CD1-CB 4.33Å; L229-E310 HydrophobicContact CD2-CG 4.32Å; V306-E310 HydrophobicContact CG2-CB 3.67Å; D307-E310 HydrophobicContact CB-CB 4.31Å; D307-E310 HydrophobicContact CB-CG 3.96Å; D307-E310 WeakPolarHBondContact CB-OE2 3.48Å; D307-E310 PolarHBondContact N-OE2 3.07Å; D307-E310 WeakPolarHBondContact O-CB 3.47Å; D307-E310 PolarHBondContact O-N 3.01Å; D307-E310 VanDerWaalsContact O-N 3.1Å; E310-L314 WeakPolarHBondContact O-CB 3.47Å; E310-L314 PolarHBondContact O-N 3.47Å; E310-Y336 HydrophobicContact CB-CE2 4.45Å; E310-Y336 HydrophobicContact CG-CD2 3.98Å; E310-Y336 HydrophobicContact CG-CE2 3.35Å
311	L	97.3	Very high	95.9	Very high	13 Å²	13	62.6 Å²	62.6	7%	0.068	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-42.4	177.9	-179.5	61.2	0	0	0	111.8	L295 E296 F299 V306 D307 L314 R315	L295-L311 HydrophobicContact CD2-CD1 4.09Å; L295-L311 HydrophobicContact CG-CD1 4.23Å; E296-L311 HydrophobicContact CG-CD2 4.01Å; F299-L311 HydrophobicContact CD2-CD1 4.14Å; F299-L311 HydrophobicContact CE2-CD1 4.01Å; V306-L311 HydrophobicContact CG1-CB 3.96Å; V306-L311 HydrophobicContact CG1-CD1 4.34Å; V306-L311 HydrophobicContact CG1-CD2 4.18Å; V306-L311 HydrophobicContact CG1-CG 4.39Å; V306-L311 HydrophobicContact CG2-CB 4.14Å; D307-L311 PolarHBondContact O-N 2.95Å; L311-L314 PolarHBondContact O-N 3.05Å; L311-R315 WeakPolarHBondContact O-CB 3.33Å; L311-R315 PolarHBondContact O-N 3.01Å
312	A	97.6	Very high	96.1	Very high	25 Å²	25	57 Å²	57	21%	0.207	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-46.2	178.3	0	0	0	0	0	112.3	E308 R309 R316	E308-A312 VanDerWaalsContact O-CB 3.22Å; E308-A312 WeakPolarHBondContact O-CB 3.3Å; E308-A312 PolarHBondContact O-N 2.87Å; R309-A312 PolarHBondContact O-N 3.08Å; A312-R316 WeakPolarHBondContact O-CG 3.38Å; A312-R316 PolarHBondContact O-N 3.43Å
313	L	98.4	Very high	96.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-47.3	174.3	176.3	59.5	0	0	0	111	F225 R309 R315 R316 L317 L326 A331 D334 Y336 F337	F225-L313 HydrophobicContact CE1-CB 4.16Å; F225-L313 HydrophobicContact CE1-CD2 3.86Å; F225-L313 HydrophobicContact CE1-CG 4.01Å; F225-L313 HydrophobicContact CZ-CD2 4.41Å; R309-L313 PolarHBondContact O-N 2.95Å; L313-R315 VanDerWaalsContact C-N 3.33Å; L313-R315 PolarHBondContact O-N 3.2Å; L313-R316 PolarHBondContact O-N 2.77Å; L313-R316 VanDerWaalsContact O-N 3.15Å; L313-L317 HydrophobicContact CD1-CD1 4.09Å; L313-L317 HydrophobicContact CD1-CG 4.08Å; L313-L317 HydrophobicContact CD2-CD1 4.49Å; L313-L317 HydrophobicContact CG-CD1 3.89Å; L313-L317 HydrophobicContact CG-CG 4.34Å; L313-L317 WeakPolarHBondContact O-CG 3.34Å; L313-L317 PolarHBondContact O-N 2.95Å; L313-L326 HydrophobicContact CD1-CD1 4.28Å; L313-A331 HydrophobicContact CD1-CB 4.24Å; L313-D334 HydrophobicContact CD1-CB 4.03Å; L313-Y336 HydrophobicContact CD2-CD1 3.47Å; L313-Y336 VanDerWaalsContact CD2-CD1 3.47Å; L313-Y336 HydrophobicContact CD2-CE1 4.22Å; L313-Y336 HydrophobicContact CD2-CG 4.05Å; L313-F337 HydrophobicContact CD2-CE2 3.75Å; L313-F337 HydrophobicContact CD2-CZ 3.9Å
314	L	98.4	Very high	96.5	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-42.9	-179.1	-177.9	62.5	0	0	0	112.2	G222 F225 A226 L229 L295 F299 E310 L311 R316 L317 L318	G222-L314 WeakPolarHBondContact O-CD1 3.47Å; F225-L314 HydrophobicContact CB-CD1 4.15Å; F225-L314 HydrophobicContact CD1-CB 4.03Å; F225-L314 HydrophobicContact CD1-CD1 3.94Å; F225-L314 HydrophobicContact CE1-CB 4.14Å; F225-L314 HydrophobicContact CG-CD1 4.37Å; A226-L314 HydrophobicContact CB-CD1 4Å; A226-L314 HydrophobicContact CB-CD2 4.03Å; L229-L314 HydrophobicContact CD1-CD2 4.45Å; L295-L314 HydrophobicContact CD1-CD2 4.43Å; L295-L314 HydrophobicContact CD2-CD2 4.17Å; L295-L314 HydrophobicContact CD2-CG 4.11Å; F299-L314 HydrophobicContact CE2-CD2 3.81Å; F299-L314 HydrophobicContact CZ-CD2 3.63Å; E310-L314 WeakPolarHBondContact O-CB 3.47Å; E310-L314 PolarHBondContact O-N 3.47Å; L311-L314 PolarHBondContact O-N 3.05Å; L314-R316 VanDerWaalsContact C-N 3.28Å; L314-R316 PolarHBondContact O-N 3.31Å; L314-L317 PolarHBondContact O-N 3.42Å; L314-L318 HydrophobicContact CD1-CD1 3.66Å; L314-L318 HydrophobicContact CD1-CG 3.99Å; L314-L318 HydrophobicContact CG-CD1 4.04Å; L314-L318 WeakPolarHBondContact O-CB 3.49Å; L314-L318 PolarHBondContact O-N 3.46Å
315	R	97.8	Very high	96.9	Very high	97 Å²	97	51.9 Å²	51.9	37%	0.366	25%	0.248	S	C	.	.	H	α-helix	trans	-57.3	-40.8	177.3	-170.6	-176	-61.2	116.4	-3.5	111.9	L295 E296 L311 L313 L318 T319	L295-R315 HydrophobicContact CD2-CB 4.5Å; E296-R315 IonicContact OE1-CZ 2.94Å; E296-R315 IonicContact OE1-NE 3.13Å; E296-R315 PolarHBondContact OE1-NE 3.13Å; E296-R315 IonicContact OE1-NH2 2.69Å; E296-R315 PolarHBondContact OE1-NH2 3Å; L311-R315 WeakPolarHBondContact O-CB 3.33Å; L311-R315 PolarHBondContact O-N 3.01Å; L313-R315 VanDerWaalsContact C-N 3.33Å; L313-R315 PolarHBondContact O-N 3.2Å; R315-L318 CarbonylContact O-C 3.57Å; R315-T319 PolarHBondContact O-N 3.41Å; R315-T319 PolarHBondContact O-OG1 3.5Å
316	R	98.3	Very high	97	Very high	81 Å²	81	43.1 Å²	43.1	31%	0.306	21%	0.211	S	C	.	.	H	α-helix	trans	-78.8	-29.1	-179	-62.3	-172.8	-55.6	130.2	16.4	113.2	A312 L313 L314 T319 L326 D334	A312-R316 WeakPolarHBondContact O-CG 3.38Å; A312-R316 PolarHBondContact O-N 3.43Å; L313-R316 PolarHBondContact O-N 2.77Å; L313-R316 VanDerWaalsContact O-N 3.15Å; L314-R316 VanDerWaalsContact C-N 3.28Å; L314-R316 PolarHBondContact O-N 3.31Å; R316-T319 PolarHBondContact O-OG1 3.02Å; R316-T319 VanDerWaalsContact O-OG1 3.09Å; R316-L326 HydrophobicContact CB-CD1 3.37Å; R316-L326 HydrophobicContact CB-CG 3.77Å; R316-L326 HydrophobicContact CG-CD1 4.45Å; R316-L326 VanDerWaalsContact NH2-CD1 3.35Å; R316-D334 IonicContact CZ-OD2 3.01Å; R316-D334 IonicContact NE-OD2 3.9Å; R316-D334 IonicContact NH1-OD2 2.75Å; R316-D334 VanDerWaalsContact NH2-CB 3.33Å; R316-D334 IonicContact NH2-OD2 3.74Å; R316-D334 PolarHBondContact NH2-OD2 3.44Å
317	L	98.7	Very high	97.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-71.6	-39.2	171.4	-68.2	171.8	0	0	0	111.7	M133 I218 F225 L313 L314 T319 R325 L326 A331	M133-L317 HydrophobicContact CE-CD1 4.38Å; I218-L317 HydrophobicContact CG2-CD2 3.53Å; F225-L317 HydrophobicContact CD1-CD1 3.98Å; L313-L317 HydrophobicContact CD1-CD1 4.09Å; L313-L317 HydrophobicContact CD1-CG 4.08Å; L313-L317 HydrophobicContact CD2-CD1 4.49Å; L313-L317 HydrophobicContact CG-CD1 3.89Å; L313-L317 HydrophobicContact CG-CG 4.34Å; L313-L317 WeakPolarHBondContact O-CG 3.34Å; L313-L317 PolarHBondContact O-N 2.95Å; L314-L317 PolarHBondContact O-N 3.42Å; L317-T319 VanDerWaalsContact C-N 3.33Å; L317-T319 PolarHBondContact O-N 2.92Å; L317-R325 VanDerWaalsContact O-CD 3.31Å; L317-R325 WeakPolarHBondContact O-CD 3.09Å; L317-R325 WeakPolarHBondContact O-CG 3.44Å; L317-L326 HydrophobicContact CD2-CD1 4.44Å; L317-A331 HydrophobicContact CD2-CB 4Å
318	L	98.6	Very high	97.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	25.4	178.7	-65.9	-178.6	0	0	0	113.6	W219 I234 F235 M260 L314 R315 M320	W219-L318 HydrophobicContact CD2-CD2 4.06Å; W219-L318 HydrophobicContact CE3-CD2 4.13Å; W219-L318 HydrophobicContact CH2-CD2 4.5Å; W219-L318 HydrophobicContact CZ2-CD2 4.43Å; W219-L318 HydrophobicContact CZ3-CB 4.38Å; W219-L318 HydrophobicContact CZ3-CD2 4.36Å; W219-L318 WeakPolarHBondContact CZ3-O 3.14Å; I234-L318 HydrophobicContact CD1-CD1 3.9Å; F235-L318 HydrophobicContact CE2-CD1 4.43Å; F235-L318 HydrophobicContact CE2-CD2 4.02Å; F235-L318 HydrophobicContact CZ-CD1 4.16Å; F235-L318 HydrophobicContact CZ-CD2 4.37Å; M260-L318 HydrophobicContact CE-CB 3.79Å; M260-L318 WeakPolarHBondContact CE-O 3.29Å; M260-L318 HydrophobicContact SD-CB 4.35Å; M260-L318 HydrophobicContact SD-CD1 4.26Å; L314-L318 HydrophobicContact CD1-CD1 3.66Å; L314-L318 HydrophobicContact CD1-CG 3.99Å; L314-L318 HydrophobicContact CG-CD1 4.04Å; L314-L318 WeakPolarHBondContact O-CB 3.49Å; L314-L318 PolarHBondContact O-N 3.46Å; R315-L318 CarbonylContact O-C 3.57Å; L318-M320 PolarHBondContact O-N 3.17Å
319	T	98.4	Very high	97.7	Very high	36 Å²	36	36.7 Å²	36.7	22%	0.221	19%	0.188	C	C	.	.			trans	-62.2	124.4	171.4	-59.5	0	0	0	0	110	R315 R316 L317 K324 R325	R315-T319 PolarHBondContact O-N 3.41Å; R315-T319 PolarHBondContact O-OG1 3.5Å; R316-T319 PolarHBondContact O-OG1 3.02Å; R316-T319 VanDerWaalsContact O-OG1 3.09Å; L317-T319 VanDerWaalsContact C-N 3.33Å; L317-T319 PolarHBondContact O-N 2.92Å; T319-K324 HydrophobicContact CG2-CB 3.85Å; T319-R325 PolarHBondContact O-NE 3.28Å; T319-R325 PolarHBondContact O-NH2 3.1Å; T319-R325 VanDerWaalsContact O-NH2 3.07Å
320	M	97.6	Very high	97.8	Very high	25 Å²	25	38 Å²	38	12%	0.123	20%	0.198	C	C	.	.	S	Bend	trans	-65.2	-41.8	-176.1	-76.2	-170.8	-92.5	0	0	113	W219 F257 M260 G261 P263 W268 L318 P322 R325	W219-M320 HydrophobicContact CH2-CG 4.43Å; W219-M320 HydrophobicContact CZ3-CG 4.32Å; F257-M320 HydrophobicContact CD1-SD 4.22Å; F257-M320 HydrophobicContact CE1-SD 3.94Å; M260-M320 HydrophobicContact CB-CE 4.1Å; M260-M320 HydrophobicContact CB-SD 4.43Å; G261-M320 VanDerWaalsContact O-CE 3.28Å; G261-M320 WeakPolarHBondContact O-CE 3.46Å; P263-M320 HydrophobicContact CB-CE 3.59Å; P263-M320 HydrophobicContact CB-SD 4.02Å; P263-M320 HydrophobicContact CG-CE 3.98Å; P263-M320 HydrophobicContact CG-SD 3.84Å; W268-M320 HydrophobicContact CE3-CB 3.96Å; W268-M320 HydrophobicContact CZ3-CB 4.33Å; L318-M320 PolarHBondContact O-N 3.17Å; M320-P322 VanDerWaalsContact O-CD 3.32Å; M320-P322 WeakPolarHBondContact O-CD 3.28Å; M320-R325 PolarHBondContact O-NH2 2.9Å; M320-R325 VanDerWaalsContact O-NH2 3.08Å
321	D	97.6	Very high	97.9	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.048	19%	0.189	C	C	.	.	S	Bend	trans	-71.2	114.9	174.3	-173.1	-19.1	0	0	0	110.2	A267 W268 V323 K324 R325	A267-D321 VanDerWaalsContact O-CB 3.29Å; A267-D321 WeakPolarHBondContact O-CB 3.26Å; W268-D321 HydrophobicContact CB-CB 3.94Å; W268-D321 HydrophobicContact CG-CB 3.83Å; D321-V323 PolarHBondContact O-N 2.82Å; D321-V323 WeakPolarHBondContact OD1-CB 3.47Å; D321-V323 PolarHBondContact OD1-N 3.1Å; D321-K324 HydrophobicContact CB-CB 4.3Å; D321-K324 HydrophobicContact CB-CD 4.2Å; D321-K324 HydrophobicContact CB-CG 4.26Å; D321-K324 PolarHBondContact O-N 3.01Å; D321-K324 VanDerWaalsContact O-N 3.15Å; D321-K324 WeakPolarHBondContact OD2-CE 3.15Å; D321-R325 PolarHBondContact O-N 3.01Å
322	P	96.6	Very high	97.9	Very high	30 Å²	30	36.4 Å²	36.4	20%	0.195	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.7	-177.6	26.1	-34.9	0	0	0	113.7	E204 A215 M320 K324	E204-P322 HydrophobicContact CB-CG 4.28Å; E204-P322 HydrophobicContact CG-CB 4.32Å; E204-P322 HydrophobicContact CG-CG 4.15Å; A215-P322 HydrophobicContact CB-CB 3.85Å; A215-P322 WeakPolarHBondContact CB-O 3.49Å; M320-P322 VanDerWaalsContact O-CD 3.32Å; M320-P322 WeakPolarHBondContact O-CD 3.28Å; P322-K324 VanDerWaalsContact C-N 3.35Å
323	V	95.8	Very high	97.9	Very high	121 Å²	121	40.6 Å²	40.6	73%	0.733	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-27.7	179.1	-179.8	0	0	0	0	111.5	D321	D321-V323 PolarHBondContact O-N 2.82Å; D321-V323 WeakPolarHBondContact OD1-CB 3.47Å; D321-V323 PolarHBondContact OD1-N 3.1Å
324	K	97.3	Very high	97.9	Very high	104 Å²	104	41.3 Å²	41.3	45%	0.452	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.1	179.7	-60.1	-179.7	-172	170.9	0	113.3	D266 A267 T319 D321 P322	D266-K324 PolarHBondContact O-NZ 3.3Å; A267-K324 PolarHBondContact O-NZ 2.8Å; T319-K324 HydrophobicContact CG2-CB 3.85Å; D321-K324 HydrophobicContact CB-CB 4.3Å; D321-K324 HydrophobicContact CB-CD 4.2Å; D321-K324 HydrophobicContact CB-CG 4.26Å; D321-K324 PolarHBondContact O-N 3.01Å; D321-K324 VanDerWaalsContact O-N 3.15Å; D321-K324 WeakPolarHBondContact OD2-CE 3.15Å; P322-K324 VanDerWaalsContact C-N 3.35Å
325	R	98	Very high	97.8	Very high	14 Å²	14	43.2 Å²	43.2	5%	0.053	22%	0.222	C	C	.	.	S	Bend	trans	-72.6	139.2	177.5	-162.1	178.6	-60.1	140.8	4.9	109.1	E204 A215 I218 L317 T319 M320 D321	E204-R325 IonicContact OE1-CZ 2.82Å; E204-R325 IonicContact OE1-NH1 3.6Å; E204-R325 PolarHBondContact OE1-NH1 2.94Å; E204-R325 IonicContact OE1-NH2 2.7Å; E204-R325 PolarHBondContact OE1-NH2 3.28Å; E204-R325 IonicContact OE2-CZ 2.95Å; E204-R325 IonicContact OE2-NH1 2.65Å; E204-R325 IonicContact OE2-NH2 3.5Å; E204-R325 PolarHBondContact OE2-NH2 3.35Å; A215-R325 VanDerWaalsContact C-NH1 3.26Å; A215-R325 HydrophobicContact CB-CB 4.44Å; A215-R325 VanDerWaalsContact O-CD 3.32Å; A215-R325 WeakPolarHBondContact O-CD 3.28Å; A215-R325 PolarHBondContact O-NH1 3.02Å; I218-R325 HydrophobicContact CB-CG 4.42Å; I218-R325 HydrophobicContact CG2-CG 4.04Å; L317-R325 VanDerWaalsContact O-CD 3.31Å; L317-R325 WeakPolarHBondContact O-CD 3.09Å; L317-R325 WeakPolarHBondContact O-CG 3.44Å; T319-R325 PolarHBondContact O-NE 3.28Å; T319-R325 PolarHBondContact O-NH2 3.1Å; T319-R325 VanDerWaalsContact O-NH2 3.07Å; M320-R325 PolarHBondContact O-NH2 2.9Å; M320-R325 VanDerWaalsContact O-NH2 3.08Å; D321-R325 PolarHBondContact O-N 3.01Å
326	L	97.3	Very high	97.8	Very high	17 Å²	17	39 Å²	39	9%	0.089	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-55.9	151.7	179.7	-69.1	168.2	0	0	0	112.2	I218 L313 R316 L317 E330 A331	I218-L326 WeakPolarHBondContact CG1-O 2.9Å; I218-L326 WeakPolarHBondContact CG2-O 3.39Å; L313-L326 HydrophobicContact CD1-CD1 4.28Å; R316-L326 HydrophobicContact CB-CD1 3.37Å; R316-L326 HydrophobicContact CB-CG 3.77Å; R316-L326 HydrophobicContact CG-CD1 4.45Å; R316-L326 VanDerWaalsContact NH2-CD1 3.35Å; L317-L326 HydrophobicContact CD2-CD1 4.44Å; L326-E330 HydrophobicContact CD2-CB 3.74Å; L326-A331 HydrophobicContact CB-CB 4.49Å; L326-A331 HydrophobicContact CD1-CB 4.12Å
327	S	98.4	Very high	97.8	Very high	41 Å²	41	35.6 Å²	35.6	29%	0.287	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-78	163.2	156.5	66.6	0	0	0	0	111.5	A329 E330 A331	S327-A329 VanDerWaalsContact C-N 3.27Å; S327-A329 PolarHBondContact O-N 2.92Å; S327-E330 VanDerWaalsContact CB-OE2 3.32Å; S327-E330 WeakPolarHBondContact CB-OE2 3.37Å; S327-E330 PolarHBondContact N-OE2 2.75Å; S327-E330 PolarHBondContact O-N 3.39Å; S327-E330 VanDerWaalsContact OG-CD 3.3Å; S327-E330 VanDerWaalsContact OG-CG 3.25Å; S327-E330 WeakPolarHBondContact OG-CG 3.43Å; S327-E330 PolarHBondContact OG-N 3.4Å; S327-E330 PolarHBondContact OG-OE2 3.16Å; S327-A331 WeakPolarHBondContact O-CB 3.29Å; S327-A331 PolarHBondContact O-N 3.16Å
328	A	98.4	Very high	97.6	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-39.6	174.7	0	0	0	0	0	112	L137 I140 H141 I218 A331 M332	L137-A328 HydrophobicContact CD2-CB 4.41Å; I140-A328 HydrophobicContact CG2-CB 4.28Å; H141-A328 HydrophobicContact CB-CB 3.79Å; I218-A328 HydrophobicContact CD1-CB 3.85Å; A328-A331 PolarHBondContact O-N 2.85Å; A328-M332 WeakPolarHBondContact O-CG 3.49Å; A328-M332 PolarHBondContact O-N 3.3Å
329	A	98.2	Very high	97.4	Very high	35 Å²	35	46.3 Å²	46.3	29%	0.289	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-47.9	177.2	0	0	0	0	0	112	S327 A331 M332 E333	S327-A329 VanDerWaalsContact C-N 3.27Å; S327-A329 PolarHBondContact O-N 2.92Å; A329-A331 VanDerWaalsContact C-N 3.29Å; A329-A331 PolarHBondContact O-N 2.95Å; A329-M332 PolarHBondContact O-N 3.45Å; A329-E333 WeakPolarHBondContact O-CG 3.49Å; A329-E333 PolarHBondContact O-N 3.01Å
330	E	98.3	Very high	97	Very high	108 Å²	108	47.6 Å²	47.6	51%	0.505	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-32	177.7	-67.5	162.8	129.7	0	0	112.7	L326 S327 E333	L326-E330 HydrophobicContact CD2-CB 3.74Å; S327-E330 VanDerWaalsContact CB-OE2 3.32Å; S327-E330 WeakPolarHBondContact CB-OE2 3.37Å; S327-E330 PolarHBondContact N-OE2 2.75Å; S327-E330 PolarHBondContact O-N 3.39Å; S327-E330 VanDerWaalsContact OG-CD 3.3Å; S327-E330 VanDerWaalsContact OG-CG 3.25Å; S327-E330 WeakPolarHBondContact OG-CG 3.43Å; S327-E330 PolarHBondContact OG-N 3.4Å; S327-E330 PolarHBondContact OG-OE2 3.16Å; E330-E333 PolarHBondContact O-N 3.24Å
331	A	98.6	Very high	96.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.2	-38.6	175.5	0	0	0	0	0	112.1	L137 L313 L317 L326 S327 A328 A329 E333 D334 F337	L137-A331 HydrophobicContact CD1-CB 3.79Å; L137-A331 HydrophobicContact CD2-CB 3.8Å; L137-A331 HydrophobicContact CG-CB 4.44Å; L313-A331 HydrophobicContact CD1-CB 4.24Å; L317-A331 HydrophobicContact CD2-CB 4Å; L326-A331 HydrophobicContact CB-CB 4.49Å; L326-A331 HydrophobicContact CD1-CB 4.12Å; S327-A331 WeakPolarHBondContact O-CB 3.29Å; S327-A331 PolarHBondContact O-N 3.16Å; A328-A331 PolarHBondContact O-N 2.85Å; A329-A331 VanDerWaalsContact C-N 3.29Å; A329-A331 PolarHBondContact O-N 2.95Å; A331-E333 PolarHBondContact O-N 3.31Å; A331-D334 WeakPolarHBondContact O-CB 3.36Å; A331-D334 PolarHBondContact O-N 3.1Å; A331-F337 VanDerWaalsContact O-CD2 3.28Å; A331-F337 WeakPolarHBondContact O-CD2 3.38Å; A331-F337 VanDerWaalsContact O-CE2 3.25Å; A331-F337 WeakPolarHBondContact O-CE2 3.45Å
332	M	98.1	Very high	96.7	Very high	18 Å²	18	59.1 Å²	59.1	9%	0.089	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-26.8	175.4	-70.3	173.1	65.8	0	0	112.8	Y134 L137 N138 H141 A328 A329 D334	Y134-M332 HydrophobicContact CE1-CE 4.15Å; Y134-M332 HydrophobicContact CE2-CB 4.17Å; Y134-M332 HydrophobicContact CE2-CE 4.01Å; Y134-M332 HydrophobicContact CE2-CG 4.36Å; L137-M332 HydrophobicContact CB-CG 3.62Å; L137-M332 HydrophobicContact CB-SD 4.24Å; L137-M332 HydrophobicContact CD1-CG 4.37Å; N138-M332 HydrophobicContact CB-CE 3.85Å; N138-M332 HydrophobicContact CB-SD 4.22Å; H141-M332 HydrophobicContact CB-SD 4.15Å; A328-M332 WeakPolarHBondContact O-CG 3.49Å; A328-M332 PolarHBondContact O-N 3.3Å; A329-M332 PolarHBondContact O-N 3.45Å; M332-D334 VanDerWaalsContact C-N 3.29Å; M332-D334 PolarHBondContact O-N 2.63Å
333	E	97.8	Very high	96.7	Very high	113 Å²	113	59.3 Å²	59.3	53%	0.528	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	6.3	178.5	-68.1	-60	132.3	0	0	113.9	A329 E330 A331 K338	A329-E333 WeakPolarHBondContact O-CG 3.49Å; A329-E333 PolarHBondContact O-N 3.01Å; E330-E333 PolarHBondContact O-N 3.24Å; A331-E333 PolarHBondContact O-N 3.31Å; E333-K338 WeakPolarHBondContact O-CD 3.46Å; E333-K338 WeakPolarHBondContact O-CE 3.35Å; E333-K338 PolarHBondContact O-NZ 3.44Å; E333-K338 WeakPolarHBondContact OE2-CE 3.47Å; E333-K338 IonicContact OE2-NZ 3.58Å; E333-K338 PolarHBondContact OE2-NZ 3.39Å
334	D	98.1	Very high	96.7	Very high	15 Å²	15	55.9 Å²	55.9	8%	0.08	29%	0.292	C	S	.	.	S	Bend	trans	-69.3	153.6	180	-172.3	-108.2	0	0	0	114	L313 R316 A331 M332 Y336 F337 K338	L313-D334 HydrophobicContact CD1-CB 4.03Å; R316-D334 IonicContact CZ-OD2 3.01Å; R316-D334 IonicContact NE-OD2 3.9Å; R316-D334 IonicContact NH1-OD2 2.75Å; R316-D334 VanDerWaalsContact NH2-CB 3.33Å; R316-D334 IonicContact NH2-OD2 3.74Å; R316-D334 PolarHBondContact NH2-OD2 3.44Å; A331-D334 WeakPolarHBondContact O-CB 3.36Å; A331-D334 PolarHBondContact O-N 3.1Å; M332-D334 VanDerWaalsContact C-N 3.29Å; M332-D334 PolarHBondContact O-N 2.63Å; D334-Y336 PolarHBondContact O-N 3.07Å; D334-Y336 WeakPolarHBondContact OD1-CB 3.09Å; D334-Y336 PolarHBondContact OD1-N 2.65Å; D334-F337 HydrophobicContact CB-CD2 4.41Å; D334-F337 PolarHBondContact O-N 3.37Å; D334-F337 VanDerWaalsContact O-N 3.07Å; D334-K338 PolarHBondContact O-N 2.87Å; D334-K338 VanDerWaalsContact O-N 3.15Å
335	S	97	Very high	96.7	Very high	41 Å²	41	57 Å²	57	29%	0.287	30%	0.302	S	S	.	.	H	α-helix	trans	-58	-30	175.9	56	0	0	0	0	112.9	F337 K338 E339	S335-F337 PolarHBondContact O-N 3.31Å; S335-K338 PolarHBondContact O-N 3.03Å; S335-E339 WeakPolarHBondContact O-CB 3.15Å; S335-E339 PolarHBondContact O-N 3.23Å
336	Y	97.5	Very high	96.7	Very high	8 Å²	8	56.8 Å²	56.8	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-53.6	-37.5	173.9	179.5	-117.6	0	0	0	113.1	K130 F225 R309 E310 L313 D334	K130-Y336 WeakPolarHBondContact CA-OH 3.4Å; K130-Y336 HydrophobicContact CB-CE1 3.96Å; K130-Y336 WeakPolarHBondContact CB-OH 3.42Å; K130-Y336 WeakPolarHBondContact CD-O 3.39Å; K130-Y336 WeakPolarHBondContact CE-O 3.22Å; K130-Y336 HydrophobicContact CG-CD1 4.19Å; K130-Y336 HydrophobicContact CG-CE1 3.65Å; K130-Y336 HydrophobicContact CG-CE2 4.47Å; K130-Y336 PolarHBondContact N-OH 2.99Å; K130-Y336 PolarHBondContact NZ-O 3.1Å; F225-Y336 HydrophobicContact CE2-CE1 4.31Å; F225-Y336 HydrophobicContact CZ-CD1 4.47Å; F225-Y336 AromaticContact CZ-CE1 3.89Å; F225-Y336 HydrophobicContact CZ-CE1 3.89Å; F225-Y336 AromaticContact CZ-CZ 3.94Å; R309-Y336 HydrophobicContact CB-CD2 4.11Å; E310-Y336 HydrophobicContact CB-CE2 4.45Å; E310-Y336 HydrophobicContact CG-CD2 3.98Å; E310-Y336 HydrophobicContact CG-CE2 3.35Å; L313-Y336 HydrophobicContact CD2-CD1 3.47Å; L313-Y336 VanDerWaalsContact CD2-CD1 3.47Å; L313-Y336 HydrophobicContact CD2-CE1 4.22Å; L313-Y336 HydrophobicContact CD2-CG 4.05Å; D334-Y336 PolarHBondContact O-N 3.07Å; D334-Y336 WeakPolarHBondContact OD1-CB 3.09Å; D334-Y336 PolarHBondContact OD1-N 2.65Å
337	F	97.7	Very high	96.8	Very high	9 Å²	9	56 Å²	56	4%	0.039	30%	0.298	C	S	.	.	H	α-helix	trans	-92.4	-29.2	178.8	-59.4	-61.1	0	0	0	113.5	K130 M133 Y134 L137 L313 A331 D334 S335 P343	K130-F337 HydrophobicContact CD-CD1 4.3Å; K130-F337 HydrophobicContact CG-CD1 3.68Å; K130-F337 HydrophobicContact CG-CE1 3.87Å; K130-F337 WeakPolarHBondContact O-CE1 3.41Å; M133-F337 HydrophobicContact CB-CE1 4.11Å; M133-F337 HydrophobicContact CB-CZ 3.93Å; Y134-F337 HydrophobicContact CD2-CB 4.11Å; Y134-F337 AromaticContact CD2-CD1 3.73Å; Y134-F337 HydrophobicContact CD2-CD1 3.73Å; Y134-F337 HydrophobicContact CD2-CD2 4.13Å; Y134-F337 HydrophobicContact CD2-CE1 4.15Å; Y134-F337 AromaticContact CD2-CG 3.72Å; Y134-F337 HydrophobicContact CD2-CG 3.72Å; Y134-F337 HydrophobicContact CE2-CB 4.42Å; Y134-F337 HydrophobicContact CE2-CG 4.43Å; Y134-F337 HydrophobicContact CG-CD1 4.29Å; Y134-F337 HydrophobicContact CG-CE1 4.45Å; L137-F337 HydrophobicContact CD1-CE2 3.59Å; L137-F337 HydrophobicContact CD1-CZ 3.74Å; L313-F337 HydrophobicContact CD2-CE2 3.75Å; L313-F337 HydrophobicContact CD2-CZ 3.9Å; A331-F337 VanDerWaalsContact O-CD2 3.28Å; A331-F337 WeakPolarHBondContact O-CD2 3.38Å; A331-F337 VanDerWaalsContact O-CE2 3.25Å; A331-F337 WeakPolarHBondContact O-CE2 3.45Å; D334-F337 HydrophobicContact CB-CD2 4.41Å; D334-F337 PolarHBondContact O-N 3.37Å; D334-F337 VanDerWaalsContact O-N 3.07Å; S335-F337 PolarHBondContact O-N 3.31Å; F337-P343 HydrophobicContact CD1-CG 3.89Å
338	K	95	Very high	96.7	Very high	126 Å²	126	54.3 Å²	54.3	55%	0.548	29%	0.286	S	S	.	.	H	α-helix	trans	-80.4	-30.3	-178.6	-70.8	178.8	172.1	164.1	0	113.6	E333 D334 S335	E333-K338 WeakPolarHBondContact O-CD 3.46Å; E333-K338 WeakPolarHBondContact O-CE 3.35Å; E333-K338 PolarHBondContact O-NZ 3.44Å; E333-K338 WeakPolarHBondContact OE2-CE 3.47Å; E333-K338 IonicContact OE2-NZ 3.58Å; E333-K338 PolarHBondContact OE2-NZ 3.39Å; D334-K338 PolarHBondContact O-N 2.87Å; D334-K338 VanDerWaalsContact O-N 3.15Å; S335-K338 PolarHBondContact O-N 3.03Å
339	E	93	Very high	96.6	Very high	101 Å²	101	54.9 Å²	54.9	47%	0.472	29%	0.292	S	S	.	.	S	Bend	trans	-103.7	148.6	-176.6	-61.1	178.1	-167	0	0	112.7	K130 R309 S335	K130-E339 PolarHBondContact NZ-O 2.96Å; K130-E339 VanDerWaalsContact NZ-O 3.13Å; R309-E339 IonicContact NH1-OE2 3.21Å; S335-E339 WeakPolarHBondContact O-CB 3.15Å; S335-E339 PolarHBondContact O-N 3.23Å
340	G	90.8	Very high	96.5	Very high	62 Å²	62	59.3 Å²	59.3	64%	0.639	31%	0.311	S	S	*	.	S	Bend	trans	73.9	-150.9	-177.5	0	0	0	0	0	112.9	K342	G340-K342 PolarHBondContact O-N 3.21Å
341	E	93	Very high	96.3	Very high	112 Å²	112	56.9 Å²	56.9	52%	0.523	30%	0.301	S	S	.	.	S	Bend	trans	-69.3	129.2	177.8	-166.7	-178.8	172.2	0	0	110.6	Y125 N127 K130	Y125-E341 PolarHBondContact OH-OE1 2.78Å; N127-E341 PolarHBondContact ND2-O 2.86Å; K130-E341 WeakPolarHBondContact CD-O 3.32Å; K130-E341 PolarHBondContact NZ-O 3.24Å; K130-E341 VanDerWaalsContact NZ-O 3.13Å
342	K	94.9	Very high	96.2	Very high	164 Å²	164	62.1 Å²	62.1	71%	0.713	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-68.3	148.7	179.8	-67.2	-175.2	179	-177.5	0	111.2	N127 G340	N127-K342 PolarHBondContact ND2-O 3.28Å; G340-K342 PolarHBondContact O-N 3.21Å
343	P	97	Very high	96.2	Very high	34 Å²	34	62.9 Å²	62.9	22%	0.221	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-49.6	141.7	170	-26.8	34.7	0	0	0	112.6	K130 Y134 F337	K130-P343 HydrophobicContact CD-CG 4.3Å; K130-P343 HydrophobicContact CG-CG 4.21Å; Y134-P343 HydrophobicContact CD1-CB 4.16Å; Y134-P343 HydrophobicContact CD1-CG 4.31Å; Y134-P343 HydrophobicContact CD2-CG 3.94Å; Y134-P343 HydrophobicContact CG-CB 3.95Å; Y134-P343 HydrophobicContact CG-CG 3.73Å; F337-P343 HydrophobicContact CD1-CG 3.89Å
344	N	96.6	Very high	96.1	Very high	49 Å²	49	59.8 Å²	59.8	26%	0.262	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-99.1	147.8	175.9	-160.6	-40.1	0	0	0	110.8	Y125 S131 Q135 D346	Y125-N344 HydrophobicContact CE1-CB 3.88Å; S131-N344 PolarHBondContact OG-N 3.06Å; Q135-N344 PolarHBondContact NE2-O 2.68Å; Q135-N344 VanDerWaalsContact NE2-O 3.08Å; N344-D346 VanDerWaalsContact C-N 3.35Å; N344-D346 WeakPolarHBondContact CB-O 3.22Å; N344-D346 PolarHBondContact OD1-N 3.16Å; N344-D346 PolarHBondContact OD1-O 2.64Å
345	N	96.9	Very high	96.1	Very high	127 Å²	127	59.8 Å²	59.8	68%	0.679	33%	0.328	S	S	*	.	S	Bend	trans	-68.3	-36.6	173.4	-73.1	-27	0	0	0	111.6	Q135	Q135-N345 PolarHBondContact NE2-O 3.09Å
346	D	98.2	Very high	96	Very high	10 Å²	10	62 Å²	62	5%	0.053	34%	0.342	C	S	.	.	S	Bend	trans	-93.5	108	167.5	173.2	12.5	0	0	0	108.5	R167 G168 N344 F348 G349 N350	R167-D346 IonicContact CZ-OD2 3.28Å; R167-D346 IonicContact NH1-OD1 3.88Å; R167-D346 IonicContact NH1-OD2 3.74Å; R167-D346 PolarHBondContact NH1-OD2 3.38Å; G168-D346 WeakPolarHBondContact CA-OD1 3.43Å; N344-D346 VanDerWaalsContact C-N 3.35Å; N344-D346 WeakPolarHBondContact CB-O 3.22Å; N344-D346 PolarHBondContact OD1-N 3.16Å; N344-D346 PolarHBondContact OD1-O 2.64Å; D346-F348 PolarHBondContact O-N 3.31Å; D346-F348 VanDerWaalsContact O-N 3.1Å; D346-F348 WeakPolarHBondContact OD1-CB 3.37Å; D346-F348 WeakPolarHBondContact OD1-CD2 3.26Å; D346-F348 PolarHBondContact OD1-N 3.4Å; D346-G349 PolarHBondContact O-N 2.87Å; D346-N350 WeakPolarHBondContact OD2-CA 2.93Å; D346-N350 PolarHBondContact OD2-N 3.43Å; D346-N350 PolarHBondContact OD2-OD1 2.71Å
347	V	98.4	Very high	96	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.6	-179.2	-57	0	0	0	0	113.4	M128 L132 V160 G168 V170	M128-V347 WeakPolarHBondContact CA-O 3.45Å; M128-V347 WeakPolarHBondContact CB-O 3.33Å; M128-V347 HydrophobicContact CG-CB 4.5Å; M128-V347 VanDerWaalsContact CG-O 3.28Å; M128-V347 WeakPolarHBondContact CG-O 3.41Å; L132-V347 HydrophobicContact CD2-CB 4.12Å; L132-V347 HydrophobicContact CD2-CG1 3.95Å; L132-V347 HydrophobicContact CD2-CG2 3.89Å; L132-V347 HydrophobicContact CG-CB 4.11Å; L132-V347 HydrophobicContact CG-CG1 4.09Å; L132-V347 HydrophobicContact CG-CG2 4.31Å; V160-V347 HydrophobicContact CG1-CG2 3.83Å; G168-V347 VanDerWaalsContact O-CG1 3.28Å; G168-V347 WeakPolarHBondContact O-CG1 3.49Å; G168-V347 WeakPolarHBondContact O-CG2 3.45Å; G168-V347 PolarHBondContact O-N 3.5Å; V170-V347 HydrophobicContact CG2-CG1 4.41Å
348	F	98	Very high	95.8	Very high	6 Å²	6	70.5 Å²	70.5	3%	0.026	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-1.3	173.8	-47.5	-54.2	0	0	0	112.7	Y125 M128 V160 D346 N350 L351 I353 Y355	Y125-F348 WeakPolarHBondContact CB-O 3.23Å; M128-F348 HydrophobicContact CE-CD1 4.1Å; M128-F348 HydrophobicContact CE-CE1 3.83Å; M128-F348 HydrophobicContact SD-CD1 4.28Å; V160-F348 HydrophobicContact CB-CZ 4.41Å; V160-F348 HydrophobicContact CG1-CE1 4.25Å; V160-F348 HydrophobicContact CG1-CE2 3.9Å; V160-F348 HydrophobicContact CG1-CZ 3.45Å; V160-F348 VanDerWaalsContact CG1-CZ 3.45Å; D346-F348 PolarHBondContact O-N 3.31Å; D346-F348 VanDerWaalsContact O-N 3.1Å; D346-F348 WeakPolarHBondContact OD1-CB 3.37Å; D346-F348 WeakPolarHBondContact OD1-CD2 3.26Å; D346-F348 PolarHBondContact OD1-N 3.4Å; F348-N350 VanDerWaalsContact C-N 3.31Å; F348-N350 PolarHBondContact O-N 2.85Å; F348-L351 WeakPolarHBondContact O-CB 3.32Å; F348-L351 PolarHBondContact O-N 2.77Å; F348-I353 HydrophobicContact CD2-CD1 3.66Å; F348-I353 HydrophobicContact CD2-CG1 3.74Å; F348-I353 HydrophobicContact CE1-CG2 4.45Å; F348-I353 HydrophobicContact CE2-CD1 3.57Å; F348-I353 HydrophobicContact CE2-CG1 4.03Å; F348-I353 HydrophobicContact CE2-CG2 4.34Å; F348-I353 HydrophobicContact CG-CG1 4.17Å; F348-I353 HydrophobicContact CZ-CD1 4.43Å; F348-I353 HydrophobicContact CZ-CG2 4.24Å; F348-Y355 AromaticContact CD1-CE2 3.95Å; F348-Y355 HydrophobicContact CD1-CE2 3.95Å; F348-Y355 AromaticContact CE1-CD2 3.95Å; F348-Y355 HydrophobicContact CE1-CD2 3.95Å; F348-Y355 AromaticContact CE1-CE2 3.51Å; F348-Y355 HydrophobicContact CE1-CE2 3.51Å; F348-Y355 HydrophobicContact CZ-CD2 4.43Å; F348-Y355 HydrophobicContact CZ-CE2 4.4Å
349	G	96.1	Very high	95.7	Very high	15 Å²	15	72.6 Å²	72.6	16%	0.155	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	34.9	173.6	0	0	0	0	0	114.4	D346 L351	D346-G349 PolarHBondContact O-N 2.87Å; G349-L351 PolarHBondContact O-N 2.84Å; G349-L351 VanDerWaalsContact O-N 3.1Å
350	N	94.6	Very high	95.7	Very high	128 Å²	128	73.1 Å²	73.1	68%	0.684	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	11.1	-172.6	-57.5	-56.6	0	0	0	115.4	D346 F348	D346-N350 WeakPolarHBondContact OD2-CA 2.93Å; D346-N350 PolarHBondContact OD2-N 3.43Å; D346-N350 PolarHBondContact OD2-OD1 2.71Å; F348-N350 VanDerWaalsContact C-N 3.31Å; F348-N350 PolarHBondContact O-N 2.85Å
351	L	96	Very high	95.7	Very high	56 Å²	56	72.6 Å²	72.6	29%	0.293	37%	0.372	S	S	.	.	S	Bend	trans	-79.6	154.2	171.3	-59.4	-179.7	0	0	0	110.4	R167 F348 G349 I353	R167-L351 PolarHBondContact NH1-O 3.29Å; R167-L351 PolarHBondContact NH2-O 2.93Å; F348-L351 WeakPolarHBondContact O-CB 3.32Å; F348-L351 PolarHBondContact O-N 2.77Å; G349-L351 PolarHBondContact O-N 2.84Å; G349-L351 VanDerWaalsContact O-N 3.1Å; L351-I353 PolarHBondContact O-N 2.98Å
352	P	96.1	Very high	95.1	Very high	111 Å²	111	69.6 Å²	69.6	72%	0.721	36%	0.363	S	S	*	.			trans	-52.6	135.8	173.7	-25.8	34.7	0	0	0	111.9	P354	P352-P354 VanDerWaalsContact O-CD 3.28Å; P352-P354 WeakPolarHBondContact O-CD 3.43Å
353	I	97.5	Very high	93.8	Very high	33 Å²	33	67 Å²	67	17%	0.169	36%	0.357	C	S	.	.			trans	-76.5	115.2	179.5	-50.9	-179.2	0	0	0	108.7	E163 F348 L351 Y355	E163-I353 HydrophobicContact CG-CD1 4.24Å; F348-I353 HydrophobicContact CD2-CD1 3.66Å; F348-I353 HydrophobicContact CD2-CG1 3.74Å; F348-I353 HydrophobicContact CE1-CG2 4.45Å; F348-I353 HydrophobicContact CE2-CD1 3.57Å; F348-I353 HydrophobicContact CE2-CG1 4.03Å; F348-I353 HydrophobicContact CE2-CG2 4.34Å; F348-I353 HydrophobicContact CG-CG1 4.17Å; F348-I353 HydrophobicContact CZ-CD1 4.43Å; F348-I353 HydrophobicContact CZ-CG2 4.24Å; L351-I353 PolarHBondContact O-N 2.98Å; I353-Y355 VanDerWaalsContact C-N 3.29Å; I353-Y355 HydrophobicContact CG2-CD2 3.5Å; I353-Y355 HydrophobicContact CG2-CE2 4.26Å; I353-Y355 HydrophobicContact CG2-CG 4.27Å; I353-Y355 PolarHBondContact O-N 2.8Å
354	P	96.1	Very high	92.3	Very high	48 Å²	48	72.4 Å²	72.4	31%	0.312	38%	0.384	S	S	.	.			trans	-83.8	-7	-175.8	34.9	-36	0	0	0	113.1	V122 V124 P352	V122-P354 HydrophobicContact CG2-CB 3.65Å; V122-P354 HydrophobicContact CG2-CG 3.88Å; V124-P354 HydrophobicContact CG1-CG 4.32Å; P352-P354 VanDerWaalsContact O-CD 3.28Å; P352-P354 WeakPolarHBondContact O-CD 3.43Å
355	Y	97.4	Very high	90.4	Very high	15 Å²	15	73.8 Å²	73.8	6%	0.059	39%	0.392	C	S	.	.	S	Bend	trans	-81.6	135.5	-172.1	-49.1	-60.8	0	0	0	111.1	I108 F111 H112 M128 F348 I353	I108-Y355 HydrophobicContact CB-CE1 4.43Å; I108-Y355 HydrophobicContact CD1-CD2 4.38Å; I108-Y355 HydrophobicContact CD1-CE2 4.35Å; I108-Y355 HydrophobicContact CG1-CD1 4.2Å; I108-Y355 HydrophobicContact CG1-CD2 3.99Å; I108-Y355 HydrophobicContact CG1-CE1 4.3Å; I108-Y355 HydrophobicContact CG1-CE2 4.14Å; I108-Y355 HydrophobicContact CG1-CG 4.05Å; I108-Y355 HydrophobicContact CG2-CE1 3.92Å; I108-Y355 HydrophobicContact CG2-CE2 4.44Å; F111-Y355 HydrophobicContact CB-CD1 4.25Å; F111-Y355 AromaticContact CD1-CD1 3.76Å; F111-Y355 HydrophobicContact CD1-CD1 3.76Å; F111-Y355 AromaticContact CD1-CE1 3.81Å; F111-Y355 HydrophobicContact CD1-CE1 3.81Å; F111-Y355 HydrophobicContact CE1-CD1 4.27Å; F111-Y355 HydrophobicContact CE1-CE1 4.31Å; F111-Y355 AromaticContact CG-CD1 3.97Å; F111-Y355 HydrophobicContact CG-CD1 3.97Å; F111-Y355 HydrophobicContact CG-CE1 4.42Å; H112-Y355 AromaticContact CD2-CE1 4Å; H112-Y355 AromaticContact NE2-CE1 3.59Å; H112-Y355 AromaticContact NE2-CZ 3.79Å; H112-Y355 PolarHBondContact NE2-OH 2.87Å; M128-Y355 HydrophobicContact CE-CE2 3.91Å; M128-Y355 VanDerWaalsContact CE-OH 3.26Å; M128-Y355 WeakPolarHBondContact CE-OH 3.42Å; M128-Y355 HydrophobicContact SD-CE2 4.48Å; M128-Y355 PolarHBondContact SD-OH 2.95Å; F348-Y355 AromaticContact CD1-CE2 3.95Å; F348-Y355 HydrophobicContact CD1-CE2 3.95Å; F348-Y355 AromaticContact CE1-CD2 3.95Å; F348-Y355 HydrophobicContact CE1-CD2 3.95Å; F348-Y355 AromaticContact CE1-CE2 3.51Å; F348-Y355 HydrophobicContact CE1-CE2 3.51Å; F348-Y355 HydrophobicContact CZ-CD2 4.43Å; F348-Y355 HydrophobicContact CZ-CE2 4.4Å; I353-Y355 VanDerWaalsContact C-N 3.29Å; I353-Y355 HydrophobicContact CG2-CD2 3.5Å; I353-Y355 HydrophobicContact CG2-CE2 4.26Å; I353-Y355 HydrophobicContact CG2-CG 4.27Å; I353-Y355 PolarHBondContact O-N 2.8Å
356	P	96.2	Very high	88.2	Confident	88 Å²	88	68.1 Å²	68.1	57%	0.571	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-62.1	151	175.1	27.2	-34	0	0	0	111
357	K	96	Very high	85.6	Confident	148 Å²	148	73.3 Å²	73.3	64%	0.643	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-67.2	160.9	170.2	-66	-169	178.4	-175	0	110.6	E102 E359	E102-K357 HydrophobicContact CG-CB 4.37Å; E102-K357 HydrophobicContact CG-CG 4.01Å; E102-K357 WeakPolarHBondContact OE1-CA 3.17Å; E102-K357 WeakPolarHBondContact OE1-CB 3.3Å; K357-E359 PolarHBondContact O-N 3.1Å
358	R	93.9	Very high	82.9	Confident	48 Å²	48	79.3 Å²	79.3	18%	0.181	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-64	134.2	176.4	-62.9	-179.3	-177.6	-80.2	-2.8	110.4	V28 A101 E102 H103 D104	V28-R358 HydrophobicContact CB-CB 4.41Å; V28-R358 HydrophobicContact CG1-CB 4.23Å; A101-R358 PolarHBondContact O-NE 2.7Å; A101-R358 VanDerWaalsContact O-NE 3.08Å; E102-R358 WeakPolarHBondContact O-CG 3.44Å; E102-R358 PolarHBondContact O-NE 3.21Å; E102-R358 PolarHBondContact OE1-N 2.73Å; E102-R358 VanDerWaalsContact OE1-N 3.1Å; H103-R358 PolarHBondContact O-NH2 3.38Å; D104-R358 IonicContact OD2-CZ 2.85Å; D104-R358 IonicContact OD2-NH1 2.77Å; D104-R358 PolarHBondContact OD2-NH1 2.97Å; D104-R358 IonicContact OD2-NH2 3.83Å; D104-R358 PolarHBondContact OD2-NH2 3.08Å
359	E	92.7	Very high	80.1	Confident	170 Å²	170	86.1 Å²	86.1	79%	0.794	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-77.8	147.9	171.6	-65.9	175.8	-179.8	0	0	110.2	K357	K357-E359 PolarHBondContact O-N 3.1Å
360	F	93.6	Very high	77.3	Confident	112 Å²	112	91.8 Å²	91.8	49%	0.491	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-80	139.9	172.2	-60.9	-54.4	0	0	0	110.6	C26 K27 V28 K38	C26-F360 HydrophobicContact CB-CD1 4.22Å; C26-F360 HydrophobicContact CB-CE1 3.83Å; C26-F360 HydrophobicContact CB-CZ 4.3Å; K27-F360 CarbonylContact O-C 3.59Å; K27-F360 VanDerWaalsContact O-CA 3.26Å; K27-F360 WeakPolarHBondContact O-CA 3.42Å; V28-F360 HydrophobicContact CG1-CD1 3.78Å; V28-F360 HydrophobicContact CG1-CE1 3.9Å; K38-F360 HydrophobicContact CB-CE1 4.02Å; K38-F360 HydrophobicContact CD-CE1 4.27Å; K38-F360 HydrophobicContact CD-CZ 4.39Å
361	I	90.1	Very high	74.5	Confident	50 Å²	50	91 Å²	91	26%	0.256	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-97.1	123.7	178	-54.6	175.1	0	0	0	107.4	K27 D365	K27-I361 HydrophobicContact CG-CB 4.48Å; K27-I361 PolarHBondContact O-N 2.87Å; I361-D365 HydrophobicContact CG2-CB 4.49Å
362	S	80.1	Confident	71.5	Confident	49 Å²	49	89.9 Å²	89.9	34%	0.343	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-71.4	149.2	171.1	77.7	0	0	0	0	110.3	D364 D365 S366	S362-D364 PolarHBondContact O-N 3.2Å; S362-D365 PolarHBondContact O-N 3.27Å; S362-D365 PolarHBondContact OG-N 3.47Å; S362-D365 PolarHBondContact OG-OD2 2.99Å; S362-S366 PolarHBondContact O-OG 2.77Å
363	D	68.5	Low	68.5	Low	109 Å²	109	89.4 Å²	89.4	58%	0.583	48%	0.481	S	S	*	.	S	Bend	trans	-61.4	-30.3	177.4	-75.5	-32.1	0	0	0	112	K27 S366	K27-D363 WeakPolarHBondContact CE-OD1 3.38Å; K27-D363 IonicContact NZ-OD1 3.11Å; K27-D363 PolarHBondContact NZ-OD1 2.88Å; D363-S366 WeakPolarHBondContact O-CB 3.38Å; D363-S366 PolarHBondContact O-N 2.57Å; D363-S366 PolarHBondContact O-OG 3.11Å
364	D	65.1	Low	65.6	Low	149 Å²	149	93.5 Å²	93.5	80%	0.797	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-70	-31.8	179	-63	-28.3	0	0	0	113.1	S362 S366	S362-D364 PolarHBondContact O-N 3.2Å; D364-S366 PolarHBondContact O-N 2.68Å
365	D	58.1	Low	62.8	Low	78 Å²	78	99.2 Å²	99.2	42%	0.417	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-74.2	-8	-179.6	-71.6	-47.4	0	0	0	114	I361 S362	I361-D365 HydrophobicContact CG2-CB 4.49Å; S362-D365 PolarHBondContact O-N 3.27Å; S362-D365 PolarHBondContact OG-N 3.47Å; S362-D365 PolarHBondContact OG-OD2 2.99Å
366	S	50.7	Low	59.8	Low	8 Å²	8	106.4 Å²	106.4	6%	0.056	56%	0.563	C	S	.	*	G	3₁₀ helix	trans	-84.4	-20.9	-162.7	-59.8	0	0	0	0	114.6	S362 D363 D364	S362-S366 PolarHBondContact O-OG 2.77Å; D363-S366 WeakPolarHBondContact O-CB 3.38Å; D363-S366 PolarHBondContact O-N 2.57Å; D363-S366 PolarHBondContact O-OG 3.11Å; D364-S366 PolarHBondContact O-N 2.68Å
367	D	42.4	Very low	57.1	Low	119 Å²	119	108.4 Å²	108.4	64%	0.636	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-21.6	-178.5	-72.3	-12.8	0	0	0	112.2	R30	R30-D367 IonicContact NH1-OD1 3.07Å; R30-D367 IonicContact NH2-OD1 3.39Å
368	D	41.3	Very low	54	Low	126 Å²	126	107.2 Å²	107.2	67%	0.674	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-27.8	-179.3	-80.7	-29.4	0	0	0	114.1	Q370 T371 G372	D368-Q370 PolarHBondContact O-N 3.45Å; D368-T371 PolarHBondContact O-N 2.69Å; D368-T371 PolarHBondContact O-OG1 3.48Å; D368-G372 PolarHBondContact O-N 3.45Å
369	K	40.7	Very low	51.2	Low	148 Å²	148	113.9 Å²	113.9	64%	0.643	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-79.1	-14	-175.1	-74.5	-177.1	-179	169.3	0	114.8	T371 G372	K369-T371 PolarHBondContact O-N 2.92Å; K369-G372 PolarHBondContact O-N 3.48Å
370	Q	36.7	Very low	48.4	Very low	135 Å²	135	112.5 Å²	112.5	63%	0.631	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-71.1	-8.3	171.1	-95.9	175.8	-14.5	0	0	113.6	D368	D368-Q370 PolarHBondContact O-N 3.45Å
371	T	35.5	Very low	45.5	Very low	111 Å²	111	111.9 Å²	111.9	68%	0.681	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-127.1	6.4	175	63.5	0	0	0	0	113.8	D368 K369	D368-T371 PolarHBondContact O-N 2.69Å; D368-T371 PolarHBondContact O-OG1 3.48Å; K369-T371 PolarHBondContact O-N 2.92Å
372	G	32.2	Very low	42.7	Very low	33 Å²	33	118.8 Å²	118.8	34%	0.34	66%	0.662	S	S	.	*			trans	-114.5	-1.4	-158.1	0	0	0	0	0	118.4	D368 K369 D374	D368-G372 PolarHBondContact O-N 3.45Å; K369-G372 PolarHBondContact O-N 3.48Å; G372-D374 PolarHBondContact O-N 3.24Å
373	A	33.6	Very low	40.6	Very low	100 Å²	100	125.2 Å²	125.2	83%	0.826	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-6.6	-173.4	0	0	0	0	0	115.5
374	D	37.7	Very low	39.1	Very low	120 Å²	120	128.5 Å²	128.5	64%	0.642	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	11.3	-173.7	-83.5	-31	0	0	0	116.6	G372 N376	G372-D374 PolarHBondContact O-N 3.24Å; D374-N376 VanDerWaalsContact C-N 3.32Å; D374-N376 PolarHBondContact O-N 3.19Å
375	K	36.2	Very low	37.6	Very low	168 Å²	168	129.3 Å²	129.3	73%	0.73	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	1.4	-176.6	-77	-173.4	178.8	174	0	116.7
376	N	34.4	Very low	36.8	Very low	166 Å²	166	129.7 Å²	129.7	89%	0.888	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	21.2	-176.1	-90	-1.3	0	0	0	116.4	D374	D374-N376 VanDerWaalsContact C-N 3.32Å; D374-N376 PolarHBondContact O-N 3.19Å
377	V	38.8	Very low	36.2	Very low	130 Å²	130	136.5 Å²	136.5	79%	0.788	76%	0.758	S	S	*	*	S	Bend	trans	-126	16.3	177.3	-166.9	0	0	0	0	113.6
378	T	32.9	Very low	35.7	Very low	122 Å²	122	135 Å²	135	75%	0.748	77%	0.771	S	S	*	*			trans	-124.4	34.9	-174.4	-18.8	0	0	0	0	115.3
379	Q	33.6	Very low	35.5	Very low	189 Å²	189	132.6 Å²	132.6	88%	0.883	78%	0.775	S	S	*	*	S	Bend	trans	-133.8	52.5	171.2	-72.8	-171.9	19.9	0	0	113
380	T	33.5	Very low	35.4	Very low	140 Å²	140	136.1 Å²	136.1	86%	0.859	79%	0.785	S	S	*	*	S	Bend	trans	-157.8	63.7	162.5	45.6	0	0	0	0	110.2
381	A	33.8	Very low	35.7	Very low	99 Å²	99	137.3 Å²	137.3	82%	0.818	79%	0.79	S	S	*	*			trans	-166.7	50.7	167.6	0	0	0	0	0	112.5
382	Q	31.3	Very low	36	Very low	195 Å²	195	137.3 Å²	137.3	91%	0.911	79%	0.79	S	S	*	*			trans	-141.5	78.9	165.8	-83.3	-174.5	-12.2	0	0	109.6
383	Q	35.2	Very low	36.4	Very low	184 Å²	184	142.1 Å²	142.1	86%	0.86	81%	0.813	S	S	*	*			trans	-163.4	138.6	154.3	-110.4	168.6	39.5	0	0	107.3
384	Q	37.9	Very low	36.8	Very low	178 Å²	178	141.8 Å²	141.8	83%	0.832	81%	0.811	S	S	*	*			trans	87.9	89.7	-180	-51.1	174.6	14.3	0	0	115.5
385	N	33.7	Very low	37.2	Very low	166 Å²	166	145.4 Å²	145.4	89%	0.888	82%	0.823	S	S	*	*				179.3	101.6	110.3	-90.2	-16	0	0	0	110.1
386	A	40.6	Very low	37.5	Very low	86 Å²	86	142.5 Å²	142.5	71%	0.711	82%	0.821	S	S	*	*			trans	-106.5	144.8	157.8	0	0	0	0	0	107.8
387	T	38.4	Very low	37.8	Very low	152 Å²	152	141.5 Å²	141.5	93%	0.933	82%	0.821	S	S	*	*			trans	83	104	169.9	70.3	0	0	0	0	117.4
388	G	32.2	Very low	37.8	Very low	87 Å²	87	139.4 Å²	139.4	90%	0.897	83%	0.826	S	S	*	*			trans	-156.8	104.7	161.5	0	0	0	0	0	108.7
389	G	37.2	Very low	38	Very low	75 Å²	75	137.6 Å²	137.6	77%	0.773	83%	0.832	S	S	*	*			trans	-137.2	133.2	175.1	0	0	0	0	0	110.8
390	R	38	Very low	38.3	Very low	223 Å²	223	134.9 Å²	134.9	84%	0.842	83%	0.834	S	S	*	*			trans	78	110.8	171.4	-80.1	179.1	165.7	166.9	-3.4	117.4
391	Q	43	Very low	38.7	Very low	160 Å²	160	132.1 Å²	132.1	75%	0.748	83%	0.833	S	S	*	*				70.6	132.8	93.8	-75.1	-179.1	-4.3	0	0	111.6
392	T	41.5	Very low	39.1	Very low	111 Å²	111	135.4 Å²	135.4	68%	0.681	83%	0.833	S	S	*	*			cis	-173.3	155.2	2.2	17.5	0	0	0	0	106.6
393	T	40.7	Very low	39.7	Very low	134 Å²	134	133.4 Å²	133.4	82%	0.822	82%	0.823	S	S	*	*			trans	74.6	125.3	148.6	52.6	0	0	0	0	123.6
394	A	41.7	Very low	39.9	Very low	93 Å²	93	129.6 Å²	129.6	77%	0.769	81%	0.813	S	S	*	*			trans	96.5	100.3	134.3	0	0	0	0	0	121.4
395	H	46.1	Very low	40.1	Very low	196 Å²	196	128.1 Å²	128.1	91%	0.907	82%	0.816	S	S	*	*			trans	38.9	146.4	140.1	-78.5	-63.9	0	0	0	125.7
396	P	43.6	Very low	40.4	Very low	106 Å²	106	128.9 Å²	128.9	69%	0.688	81%	0.814	S	S	*	*			trans	-116.9	165.7	-167.3	42.2	-28.5	0	0	0	115.4
397	T	39.9	Very low	40.8	Very low	145 Å²	145	129.7 Å²	129.7	89%	0.89	81%	0.812	S	S	*	*			trans	-161.4	127.3	151.4	43.7	0	0	0	0	113
398	G	38	Very low	40.9	Very low	87 Å²	87	130.1 Å²	130.1	90%	0.897	80%	0.803	S	S	*	*			trans	87	130.6	135.6	0	0	0	0	0	120
399	G	38.6	Very low	41.3	Very low	83 Å²	83	133.4 Å²	133.4	86%	0.856	80%	0.795	S	S	*	*			trans	138.6	101.8	149.3	0	0	0	0	0	116.8
400	S	40.3	Very low	41.4	Very low	133 Å²	133	134.2 Å²	134.2	93%	0.93	79%	0.789	S	S	*	*			trans	-65.7	158.2	175.3	-46	0	0	0	0	114.8
401	G	40.2	Very low	41.4	Very low	81 Å²	81	132.1 Å²	132.1	84%	0.835	79%	0.789	S	S	*	*			trans	170.9	113.6	161.9	0	0	0	0	0	115.6
402	M	43.5	Very low	41.3	Very low	168 Å²	168	134.3 Å²	134.3	83%	0.828	80%	0.799	S	S	*	*			trans	-73.9	149.5	178.1	-66.3	151.5	68.6	0	0	113.1
403	H	43.6	Very low	41.1	Very low	153 Å²	153	137.5 Å²	137.5	71%	0.708	81%	0.806	S	S	*	*				157.8	119.1	117.5	-100.9	-78.4	0	0	0	114.7
404	T	38.8	Very low	40.7	Very low	104 Å²	104	136 Å²	136	64%	0.638	80%	0.801	S	S	*	*			trans	23	130.5	133.6	58.7	0	0	0	0	121.2
405	T	41.7	Very low	40.6	Very low	147 Å²	147	140.1 Å²	140.1	90%	0.902	80%	0.804	S	S	*	*				170.8	163.3	106	36.8	0	0	0	0	112.4
406	H	40.7	Very low	40.3	Very low	183 Å²	183	139.3 Å²	139.3	85%	0.847	80%	0.801	S	S	*	*			trans	-108.7	-170.4	-152.1	-127.2	-27	0	0	0	111.6
407	P	49.3	Very low	39.9	Very low	102 Å²	102	143 Å²	143	66%	0.662	81%	0.809	S	S	*	*				-117.2	179.5	-125.6	43.1	-28.7	0	0	0	115.6
408	H	40.3	Very low	39.6	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.745	80%	0.803	S	S	*	*			trans	-162.6	138.2	154.3	-111.7	-12.8	0	0	0	115.3
409	Q	40.2	Very low	39.5	Very low	157 Å²	157	146.8 Å²	146.8	73%	0.734	81%	0.805	S	S	*	*			trans	53.6	146.5	135.8	-74.7	173	0.4	0	0	119.9
410	S	39	Very low	39.4	Very low	91 Å²	91	151.4 Å²	151.4	64%	0.636	81%	0.805	S	S	*	*			cis	179.1	153.7	2.2	37.9	0	0	0	0	108
411	Q	39.5	Very low	39.2	Very low	180 Å²	180	153.4 Å²	153.4	84%	0.841	80%	0.799	S	S	*	*			trans	53.1	123.9	147.7	-72.8	175	-5.4	0	0	121.3
412	Q	40.3	Very low	39.1	Very low	205 Å²	205	158.3 Å²	158.3	96%	0.958	80%	0.8	S	S	*	*				-168.1	156.8	113.9	-105	171.8	28.7	0	0	112.7
413	Q	37.6	Very low	38.8	Very low	179 Å²	179	159.7 Å²	159.7	84%	0.836	81%	0.805	S	S	*	*			trans	-123.5	152.1	-153	-158.5	176.4	23.5	0	0	109.8
414	S	32.8	Very low	38.5	Very low	101 Å²	101	164.5 Å²	164.5	71%	0.706	82%	0.817	S	S	*	*			trans	66.6	122.2	147.7	54.2	0	0	0	0	122.3
415	Q	39.2	Very low	38.3	Very low	181 Å²	181	162.9 Å²	162.9	85%	0.846	82%	0.82	S	S	*	*			trans	177.5	147.5	137.5	-99.7	172.6	33.8	0	0	107.1
416	Q	38.5	Very low	38.1	Very low	179 Å²	179	164 Å²	164	84%	0.836	82%	0.821	S	S	*	*			cis	-171.8	153.3	-21.5	-126.8	175.9	22	0	0	104.6
417	Q	35.4	Very low	37.9	Very low	183 Å²	183	163 Å²	163	86%	0.855	82%	0.822	S	S	*	*			trans	-64	149.4	178.1	-72	164.9	-22.1	0	0	113.5
418	S	35.1	Very low	37.4	Very low	110 Å²	110	162.5 Å²	162.5	77%	0.769	83%	0.827	S	S	*	*				169.5	121.1	126.1	39.8	0	0	0	0	112
419	Q	36.1	Very low	37.3	Very low	202 Å²	202	161 Å²	161	94%	0.944	83%	0.831	S	S	*	*			trans	177.9	103.9	131.5	-97.4	171.9	38	0	0	109.9
420	Q	34.6	Very low	37.2	Very low	180 Å²	180	162.6 Å²	162.6	84%	0.841	84%	0.839	S	S	*	*			trans	-116	154.4	159.9	-104.2	-174.9	18.6	0	0	107.6
421	Q	37.4	Very low	37.1	Very low	175 Å²	175	163.9 Å²	163.9	82%	0.818	84%	0.844	S	S	*	*			trans	81.3	103.7	169.5	-65.1	177.6	11.1	0	0	117.6
422	Q	37.5	Very low	36.9	Very low	183 Å²	183	164.5 Å²	164.5	86%	0.855	85%	0.847	S	S	*	*				-176.5	114.4	117.4	-99.7	163.7	29	0	0	109.6
423	Q	37.6	Very low	36.8	Very low	198 Å²	198	162.8 Å²	162.8	93%	0.925	84%	0.844	S	S	*	*				166.2	97	126.2	-87.7	170.8	33.9	0	0	110
424	R	36.1	Very low	36.9	Very low	254 Å²	254	159.7 Å²	159.7	96%	0.958	84%	0.839	S	S	*	*			trans	-90.1	141.3	154.8	-97.1	-174.6	175	-173.3	-0.7	107.5
425	G	35.3	Very low	37	Very low	69 Å²	69	162.6 Å²	162.6	71%	0.711	85%	0.846	S	S	*	*			trans	109.2	100.3	151.5	0	0	0	0	0	115.6
426	N	37.2	Very low	37.6	Very low	171 Å²	171	160.1 Å²	160.1	91%	0.914	85%	0.846	S	S	*	*				-167.3	130.3	111.1	-107	-8.6	0	0	0	112.4
427	N	37.2	Very low	37.5	Very low	162 Å²	162	160.5 Å²	160.5	87%	0.866	85%	0.847	S	S	*	*			trans	-63.6	141.6	164.7	-78.2	-32.9	0	0	0	110.8
428	A	37.9	Very low	37.7	Very low	92 Å²	92	160.1 Å²	160.1	76%	0.76	85%	0.846	S	S	*	*			trans	-166.7	124.3	136.9	0	0	0	0	0	109.5
429	P	38.3	Very low	38	Very low	129 Å²	129	162.7 Å²	162.7	84%	0.838	85%	0.846	S	S	*	*			trans	-84.8	132.1	164.6	32	-25.6	0	0	0	109
430	Q	38.3	Very low	38.1	Very low	191 Å²	191	162.2 Å²	162.2	89%	0.893	84%	0.843	S	S	*	*			trans	-106.5	147.3	167.9	-91.3	-164.8	-8.5	0	0	111.9
431	P	37.4	Very low	38.3	Very low	117 Å²	117	165.4 Å²	165.4	76%	0.76	85%	0.848	S	S	*	*			trans	-101.7	169	-153.6	8.3	15.3	0	0	0	113.2
432	Q	34.6	Very low	38.3	Very low	193 Å²	193	163.1 Å²	163.1	90%	0.902	85%	0.846	S	S	*	*			trans	-48.3	138	170.7	-67.2	167.3	-18	0	0	113.5
433	L	38.6	Very low	38.3	Very low	170 Å²	170	162.3 Å²	162.3	89%	0.89	85%	0.847	S	S	*	*			trans	-105.7	133.2	162.7	-88.8	157.6	0	0	0	109.6
434	P	40	Very low	38.2	Very low	113 Å²	113	156.7 Å²	156.7	73%	0.734	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-89.7	157.6	-173.8	33.7	-31.4	0	0	0	113.8
435	L	34.4	Very low	38.4	Very low	162 Å²	162	153.8 Å²	153.8	85%	0.848	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-60.6	147.7	169.6	-82.4	83.7	0	0	0	112.3
436	P	51.3	Low	39.1	Very low	130 Å²	130	156.1 Å²	156.1	84%	0.844	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-89.8	121.9	157.7	10	7.9	0	0	0	111.5
437	Q	36.6	Very low	40.1	Very low	186 Å²	186	153.8 Å²	153.8	87%	0.869	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-91.9	128.4	153	-82.3	179.7	4.2	0	0	108.9
438	Q	41.1	Very low	40.5	Very low	175 Å²	175	151.4 Å²	151.4	82%	0.818	83%	0.83	S	S	*	*			trans	170.5	147.1	154.4	-100.7	171.7	23.1	0	0	106.5
439	Q	40.9	Very low	40.8	Very low	165 Å²	165	154.9 Å²	154.9	77%	0.771	84%	0.835	S	S	*	*			cis	-164.4	136.6	-15.8	-129.1	169.5	19.6	0	0	103.2
440	Q	37.3	Very low	41	Very low	192 Å²	192	155.4 Å²	155.4	90%	0.897	83%	0.831	S	S	*	*			trans	-69.7	128.2	168.4	-73.7	164.7	-12.3	0	0	109.5
441	R	39.7	Very low	40.9	Very low	247 Å²	247	151.8 Å²	151.8	93%	0.932	82%	0.822	S	S	*	*			trans	-149.6	128.5	140.7	-73.3	-158.5	-171.6	-160.4	1.8	110.6
442	T	38	Very low	41.2	Very low	126 Å²	126	155.8 Å²	155.8	77%	0.773	83%	0.831	S	S	*	*			trans	-90.8	161.7	174.7	42	0	0	0	0	111.4
443	N	35.9	Very low	41.3	Very low	167 Å²	167	155 Å²	155	89%	0.893	83%	0.827	S	S	*	*			trans	88.1	117.1	160.3	-66.4	-3.7	0	0	0	119.5
444	G	36.8	Very low	41.3	Very low	80 Å²	80	155.9 Å²	155.9	83%	0.825	83%	0.826	S	S	*	*			trans	171.8	116.4	160.1	0	0	0	0	0	112
445	Q	39	Very low	41.2	Very low	192 Å²	192	158 Å²	158	90%	0.897	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-64.6	163.3	-174.3	-70.5	164	-61.9	0	0	115.7
446	P	51.4	Low	41.3	Very low	118 Å²	118	157.4 Å²	157.4	77%	0.766	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-90.9	155.3	170	36.5	-30.6	0	0	0	112.8
447	P	57.6	Low	40.8	Very low	122 Å²	122	158.5 Å²	158.5	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-96.7	159.3	177.3	37.4	-31.6	0	0	0	113.2
448	P	45.6	Very low	40.8	Very low	113 Å²	113	157.3 Å²	157.3	73%	0.734	81%	0.809	S	S	*	*			trans	-113.7	156.5	166.8	38.5	-27.3	0	0	0	112.7
449	L	44.9	Very low	40.7	Very low	164 Å²	164	155.6 Å²	155.6	86%	0.859	81%	0.806	S	S	*	*			trans	176.2	152	158.9	-118.6	92.5	0	0	0	107.2
450	N	42	Very low	40.5	Very low	141 Å²	141	152.7 Å²	152.7	75%	0.754	80%	0.804	S	S	*	*			cis	-165.7	162	-15	-136.8	-1.7	0	0	0	107.5
451	T	35.9	Very low	40.5	Very low	115 Å²	115	147 Å²	147	71%	0.706	80%	0.797	S	S	*	*			trans	-77	150.7	-172.8	-31.5	0	0	0	0	115.1
452	Q	44	Very low	40.5	Very low	201 Å²	201	144.3 Å²	144.3	94%	0.939	80%	0.795	S	S	*	*			trans	-165.5	146.3	136.6	-113.4	172.4	20.9	0	0	114.5
453	Q	35.8	Very low	40.6	Very low	176 Å²	176	143.3 Å²	143.3	82%	0.822	79%	0.793	S	S	*	*			trans	-102.1	155.1	-170.6	-67.3	168.7	-4.9	0	0	113.1
454	Q	39.9	Very low	40.9	Very low	188 Å²	188	143 Å²	143	88%	0.879	79%	0.791	S	S	*	*			trans	170.3	112.6	136	-99	168.2	15.9	0	0	109.3
455	Q	37.6	Very low	41.3	Very low	159 Å²	159	143.7 Å²	143.7	74%	0.743	78%	0.781	S	S	*	*				70.2	106.6	85.9	-81.8	-170	15.5	0	0	118.1
456	Q	37	Very low	41.3	Very low	149 Å²	149	144 Å²	144	70%	0.696	78%	0.783	S	S	*	*				77.1	141.4	127.7	-63.2	-179.1	18.2	0	0	124.1
457	H	40.6	Very low	40.6	Very low	152 Å²	152	144.9 Å²	144.9	70%	0.704	79%	0.786	S	S	*	*			trans	104.5	103.9	149.8	-80.3	-70.5	0	0	0	122.1
458	M	36.7	Very low	39.7	Very low	162 Å²	162	150.2 Å²	150.2	80%	0.798	79%	0.79	S	S	*	*				39	121	124.9	-65.3	-98.8	-155.5	0	0	120.2
459	N	37.7	Very low	39.3	Very low	138 Å²	138	153.8 Å²	153.8	74%	0.738	80%	0.797	S	S	*	*				153	137.7	91.3	-150.4	10.8	0	0	0	113.2
460	S	38.1	Very low	38.7	Very low	104 Å²	104	153 Å²	153	73%	0.727	79%	0.793	S	S	*	*			trans	50.9	128.8	147.5	58.6	0	0	0	0	123.2
461	G	36.9	Very low	38.4	Very low	74 Å²	74	153.3 Å²	153.3	76%	0.763	79%	0.793	S	S	*	*			trans	149.4	86.1	144.6	0	0	0	0	0	119.1
462	Q	39.9	Very low	38.2	Very low	190 Å²	190	154.7 Å²	154.7	89%	0.888	79%	0.791	S	S	*	*			trans	48.7	118.1	138.9	-71.4	177.3	-5.7	0	0	123.6
463	S	39.2	Very low	37.7	Very low	104 Å²	104	153.2 Å²	153.2	73%	0.727	78%	0.784	S	S	*	*				86.1	120.3	123.4	69.2	0	0	0	0	123.2
464	N	42.5	Very low	37.6	Very low	160 Å²	160	152.5 Å²	152.5	86%	0.856	78%	0.781	S	S	*	*			trans	92.5	146.2	140.4	-91.1	7.7	0	0	0	122.1
465	P	44.3	Very low	37.4	Very low	96 Å²	96	150.2 Å²	150.2	62%	0.623	78%	0.775	S	S	*	*				-120.9	158	-126.9	39.5	-26.9	0	0	0	113.1
466	H	38.9	Very low	37.2	Very low	199 Å²	199	149.5 Å²	149.5	92%	0.921	78%	0.776	S	S	*	*			trans	-150.6	117.6	155.2	-106.4	33.2	0	0	0	111	R468	H466-R468 PolarHBondContact O-N 3Å
467	T	37.4	Very low	37.1	Very low	135 Å²	135	148.9 Å²	148.9	83%	0.828	78%	0.778	S	S	*	*			trans	-66.9	108	175.1	-48.5	0	0	0	0	110
468	R	37.9	Very low	36.9	Very low	235 Å²	235	149.3 Å²	149.3	89%	0.887	79%	0.785	S	S	*	*			trans	-113.2	110.9	156.4	-95.6	-173.8	176	-179.2	-0.2	107.4	H466	H466-R468 PolarHBondContact O-N 3Å
469	Q	37.2	Very low	36.7	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.874	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.6	132.6	170.3	-86.6	179.9	-9.4	0	0	109.8
470	L	33.4	Very low	36.7	Very low	147 Å²	147	150.2 Å²	150.2	77%	0.77	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.5	136.6	-176.2	-80.7	117.1	0	0	0	112.3	H472	L470-H472 PolarHBondContact O-N 3.26Å
471	I	34.7	Very low	36.5	Very low	149 Å²	149	151 Å²	151	76%	0.764	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.4	118.9	147	-66.3	165.4	0	0	0	106.7	Q473	I471-Q473 HydrophobicContact CG2-CG 4.45Å
472	H	33.4	Very low	36.3	Very low	144 Å²	144	152.5 Å²	152.5	67%	0.667	79%	0.793	S	S	*	*			trans	-111	103.5	163	-117.1	55.5	0	0	0	108.1	L470	L470-H472 PolarHBondContact O-N 3.26Å
473	Q	33	Very low	36.1	Very low	170 Å²	170	150.9 Å²	150.9	79%	0.794	79%	0.79	S	S	*	*			trans	-72.8	123.6	154.1	-71.9	175	12.9	0	0	106.9	I471	I471-Q473 HydrophobicContact CG2-CG 4.45Å
474	Q	34.5	Very low	35.9	Very low	160 Å²	160	156.2 Å²	156.2	75%	0.748	80%	0.8	S	S	*	*			trans	-116	102.1	160.6	-93.5	172.3	-8.1	0	0	107.9
475	N	33.7	Very low	35.2	Very low	141 Å²	141	159.4 Å²	159.4	75%	0.754	80%	0.8	S	S	*	*			trans	-61.6	123.1	151.4	-93.5	-16.8	0	0	0	107.7
476	N	35.1	Very low	34.6	Very low	143 Å²	143	161.4 Å²	161.4	77%	0.765	81%	0.81	S	S	*	*			trans	-118.7	100	152.4	-87	-7.6	0	0	0	107.4
477	N	33.9	Very low	34.3	Very low	137 Å²	137	163.3 Å²	163.3	73%	0.733	81%	0.809	S	S	*	*			trans	-79.1	127.6	153.4	-84	-20.1	0	0	0	106.8
478	D	35.7	Very low	33.7	Very low	161 Å²	161	165.2 Å²	165.2	86%	0.861	81%	0.813	S	S	*	*			trans	-130	104.7	154.1	-86.8	-40.8	0	0	0	108.1
479	D	34.1	Very low	33.5	Very low	150 Å²	150	159.2 Å²	159.2	80%	0.802	81%	0.808	S	S	*	*			trans	-67.2	134.6	166.9	-82.1	-53.7	0	0	0	110.8
480	I	36.1	Very low	33.2	Very low	168 Å²	168	159.8 Å²	159.8	86%	0.862	81%	0.81	S	S	*	*			trans	-144.7	137.6	146	-63	-169.5	0	0	0	109.5
481	P	35.3	Very low	33.2	Very low	120 Å²	120	156.2 Å²	156.2	78%	0.779	81%	0.809	S	S	*	*			trans	-105.1	171.8	-142.3	39	-33	0	0	0	116.5
482	S	32.4	Very low	33.1	Very low	107 Å²	107	156.2 Å²	156.2	75%	0.748	81%	0.81	S	S	*	*			trans	-82.6	131	177.9	35.1	0	0	0	0	113.6
483	N	35.3	Very low	33.2	Very low	155 Å²	155	156.5 Å²	156.5	83%	0.829	82%	0.817	S	S	*	*			trans	155.6	114.3	135.5	-89.2	-31.5	0	0	0	111.9
484	K	34.6	Very low	33.3	Very low	216 Å²	216	155.6 Å²	155.6	94%	0.939	82%	0.818	S	S	*	*				-170.8	133.9	129.8	-106.3	170.4	-175.6	-179.8	0	110.6
485	R	27.8	Very low	33.4	Very low	228 Å²	228	155 Å²	155	86%	0.86	83%	0.825	S	S	*	*			trans	-120	113.7	-171.7	179.5	-167	-161.7	-174.9	5.8	107.6
486	V	32.6	Very low	33.6	Very low	137 Å²	137	153.6 Å²	153.6	83%	0.83	83%	0.827	S	S	*	*			trans	-155.5	104	163.4	-174.7	0	0	0	0	107
487	R	31.5	Very low	33.7	Very low	239 Å²	239	155.1 Å²	155.1	90%	0.902	83%	0.833	S	S	*	*				59.2	127.3	99.7	-96.2	-170.2	-174.2	-176.5	2.6	116.3
488	L	26.4	Very low	34.1	Very low	175 Å²	175	152.5 Å²	152.5	92%	0.916	83%	0.83	S	S	*	*			trans	-53.5	137.1	-179.8	-69.6	125.9	0	0	0	115.2
489	S	32.5	Very low	34.9	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	83%	0.826	S	S	*	*			trans	-169.3	120	135	56.6	0	0	0	0	111.1
490	Q	32.3	Very low	35.5	Very low	199 Å²	199	149 Å²	149	93%	0.93	82%	0.824	S	S	*	*			trans	43.4	126	141.6	-62	179.6	-6.5	0	0	121.1
491	G	32.2	Very low	35.9	Very low	72 Å²	72	147 Å²	147	74%	0.742	82%	0.823	S	S	*	*			trans	114.1	96.5	137.2	0	0	0	0	0	117.9
492	N	33.2	Very low	36.6	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	83%	0.828	S	S	*	*			trans	40	115.3	138.8	-69.3	6.7	0	0	0	120.6
493	N	35.9	Very low	37.4	Very low	150 Å²	150	150 Å²	150	80%	0.802	83%	0.829	S	S	*	*				155.4	135.4	84.6	-104.3	-1.9	0	0	0	112.1
494	D	35.1	Very low	37.4	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	83%	0.829	S	S	*	*			trans	-72.3	157.3	-174.3	-69.2	-56.8	0	0	0	115.9
495	T	36.5	Very low	37.8	Very low	149 Å²	149	143 Å²	143	91%	0.914	83%	0.826	S	S	*	*			trans	-139.8	108.4	143.9	8.5	0	0	0	0	109.5
496	S	37.5	Very low	38.3	Very low	111 Å²	111	137.1 Å²	137.1	78%	0.776	82%	0.82	S	S	*	*			trans	-101.1	141.7	171.3	67.3	0	0	0	0	110
497	I	37.4	Very low	38.2	Very low	174 Å²	174	137.3 Å²	137.3	89%	0.892	82%	0.821	S	S	*	*			trans	-94.1	115.8	177.6	-63.9	172.8	0	0	0	107.7
498	A	42.6	Very low	38.4	Very low	83 Å²	83	132.1 Å²	132.1	69%	0.686	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-91.8	147.1	174.4	0	0	0	0	0	111.6
499	P	51.1	Low	38.6	Very low	119 Å²	119	129.1 Å²	129.1	77%	0.773	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-78.3	160.4	170.7	32.1	-31.7	0	0	0	112.1
500	P	46.9	Very low	38.8	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-76.9	159.7	-166.6	32.1	-35.4	0	0	0	113.9
501	P	44.2	Very low	38.7	Very low	127 Å²	127	126.5 Å²	126.5	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.1	146.1	-175.8	33.6	-32.6	0	0	0	112.7
502	L	51.5	Low	38.9	Very low	168 Å²	168	129.8 Å²	129.8	88%	0.88	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.5	146	170.8	-79.7	156.8	0	0	0	111.4
503	P	48.3	Very low	38.8	Very low	121 Å²	121	128.5 Å²	128.5	79%	0.786	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-78.1	135.3	-177.7	30.3	-31.8	0	0	0	112.6
504	S	36.4	Very low	38.8	Very low	119 Å²	119	127.3 Å²	127.3	83%	0.832	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.6	121	171	49.7	0	0	0	0	111.5
505	A	42.4	Very low	38.7	Very low	105 Å²	105	126.9 Å²	126.9	87%	0.868	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-88.5	118.1	168.1	0	0	0	0	0	110.4
506	S	37.1	Very low	38.6	Very low	104 Å²	104	124.4 Å²	124.4	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.5	135.6	176.7	47.3	0	0	0	0	112.9
507	T	30.5	Very low	38.4	Very low	141 Å²	141	124.9 Å²	124.9	87%	0.865	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.4	126	160.6	42.7	0	0	0	0	111
508	T	37.3	Very low	38.3	Very low	130 Å²	130	119.8 Å²	119.8	80%	0.798	79%	0.79	S	S	*	*			trans	-133.1	114.9	160.5	20.2	0	0	0	0	109.9
509	S	30.6	Very low	37.9	Very low	113 Å²	113	122.9 Å²	122.9	79%	0.79	79%	0.793	S	S	*	*			trans	-74.2	134.9	167	48.2	0	0	0	0	111
510	T	36.6	Very low	37.1	Very low	142 Å²	142	123.9 Å²	123.9	87%	0.871	79%	0.791	S	S	*	*			trans	-142.5	113.7	154.5	28.1	0	0	0	0	110
511	S	30.2	Very low	36.8	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	79%	0.787	S	S	*	*			trans	-72.8	137.6	165.1	47.9	0	0	0	0	111.1
512	T	36	Very low	36.3	Very low	142 Å²	142	125 Å²	125	87%	0.871	78%	0.783	S	S	*	*			trans	-149.3	116.9	146.4	-39.6	0	0	0	0	110.1
513	T	30.5	Very low	35.6	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	78%	0.781	S	S	*	*			trans	-74.1	157	172.3	-42.1	0	0	0	0	110.3
514	V	37.4	Very low	35	Very low	126 Å²	126	123.8 Å²	123.8	76%	0.764	78%	0.775	S	S	*	*				155.6	105.8	129.7	169.4	0	0	0	0	111.2
515	N	32.3	Very low	35.2	Very low	142 Å²	142	125.9 Å²	125.9	76%	0.759	78%	0.777	S	S	*	*			trans	52.9	120.2	131.2	-82.2	1.7	0	0	0	123.1
516	S	33.2	Very low	34.8	Very low	96 Å²	96	130.1 Å²	130.1	67%	0.671	78%	0.776	S	S	*	*				136.6	123.8	89.3	-92.6	0	0	0	0	116
517	S	33.5	Very low	35	Very low	121 Å²	121	129.9 Å²	129.9	85%	0.846	77%	0.772	S	S	*	*			trans	81.6	124.6	133.1	-52.8	0	0	0	0	122.3
518	G	36.3	Very low	35.2	Very low	67 Å²	67	127.9 Å²	127.9	69%	0.691	76%	0.764	S	S	*	*			trans	137.2	85	150.2	0	0	0	0	0	114.4
519	I	34.3	Very low	35.2	Very low	148 Å²	148	128.5 Å²	128.5	76%	0.759	76%	0.761	S	S	*	*				92.1	116.4	74.5	-76.6	-180	0	0	0	114.3
520	L	34.6	Very low	35.5	Very low	140 Å²	140	129.8 Å²	129.8	73%	0.733	76%	0.764	S	S	*	*			trans	77.6	140.3	146.8	-64.6	169.1	0	0	0	119.6
521	H	39.2	Very low	35.6	Very low	149 Å²	149	126.2 Å²	126.2	69%	0.69	76%	0.756	S	S	*	*			cis	-153.9	129.2	16.8	-89.6	-24.7	0	0	0	110.4
522	T	34.6	Very low	35.8	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	76%	0.762	S	S	*	*				33.5	123.3	108.4	63.7	0	0	0	0	119.2
523	N	36.8	Very low	35.8	Very low	156 Å²	156	127.6 Å²	127.6	83%	0.834	75%	0.75	S	S	*	*				-165	149.1	102.2	-139.6	-9.2	0	0	0	113.8
524	T	35.7	Very low	36	Very low	107 Å²	107	129.8 Å²	129.8	66%	0.656	75%	0.751	S	S	*	*			trans	-94.8	154.5	-168.6	46.3	0	0	0	0	113.6
525	N	39.2	Very low	35.9	Very low	163 Å²	163	132.3 Å²	132.3	87%	0.872	76%	0.755	S	S	*	*				-174.5	131.8	118.5	-94.7	-15.1	0	0	0	113.7
526	K	34.3	Very low	35.8	Very low	194 Å²	194	132.9 Å²	132.9	84%	0.843	76%	0.757	S	S	*	*			trans	-111.9	-167.6	163.9	-130	-172.6	-173.3	179.7	0	104.7
527	P	42.1	Very low	35.9	Very low	99 Å²	99	134 Å²	134	64%	0.643	77%	0.765	S	S	*	*			cis	-147.4	-178.9	6	35.4	-10.8	0	0	0	117.9
528	S	34	Very low	35.6	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	76%	0.762	S	S	*	*			trans	77.4	146.9	135.7	68.4	0	0	0	0	119.4
529	I	38.2	Very low	35.6	Very low	143 Å²	143	139.5 Å²	139.5	73%	0.733	77%	0.767	S	S	*	*			cis	-167	134.7	46.7	-84.8	-172.5	0	0	0	112.2
530	T	36.4	Very low	35.2	Very low	139 Å²	139	138.3 Å²	138.3	85%	0.853	77%	0.767	S	S	*	*			trans	43.8	144.7	141.2	70.1	0	0	0	0	128.7
531	G	38.5	Very low	35.2	Very low	68 Å²	68	137.5 Å²	137.5	70%	0.701	77%	0.768	S	S	*	*			trans	156.2	90.8	135.4	0	0	0	0	0	114.9
532	Q	35.8	Very low	34.5	Very low	194 Å²	194	136 Å²	136	91%	0.907	77%	0.769	S	S	*	*				55.9	141.3	111.4	-69.4	-172.5	11.1	0	0	116.8
533	S	35.3	Very low	34.4	Very low	87 Å²	87	136.2 Å²	136.2	61%	0.608	77%	0.771	S	S	*	*			cis	-171.8	147.3	3.1	-110.4	0	0	0	0	110.3
534	Q	33.6	Very low	34.1	Very low	167 Å²	167	135.2 Å²	135.2	78%	0.78	77%	0.77	S	S	*	*			trans	48.2	127.7	141.5	-53.9	-180	8.3	0	0	123.1
535	Q	35.3	Very low	33.7	Very low	178 Å²	178	137 Å²	137	83%	0.832	78%	0.782	S	S	*	*				179.2	156.2	89.8	-93.3	-165.9	1.7	0	0	113.5
536	L	30.2	Very low	33.5	Very low	155 Å²	155	135.1 Å²	135.1	81%	0.812	78%	0.781	S	S	*	*			trans	-76.8	157.9	-168.7	-65	114.7	0	0	0	115.6
537	S	35.3	Very low	33.2	Very low	119 Å²	119	129 Å²	129	83%	0.832	77%	0.773	S	S	*	*				179.8	139.4	114.1	42.5	0	0	0	0	113.3
538	N	28.6	Very low	32.8	Very low	147 Å²	147	136 Å²	136	79%	0.786	79%	0.789	S	S	*	*			trans	-74.3	147.4	177.4	-65.1	-38	0	0	0	112.1
539	I	35.5	Very low	32.8	Very low	157 Å²	157	135.2 Å²	135.2	81%	0.805	79%	0.788	S	S	*	*			trans	-135.7	108.3	150.7	-61.3	-177.9	0	0	0	109.2
540	T	26.9	Very low	32.5	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	79%	0.79	S	S	*	*			trans	-89.5	138.1	160.3	-56.1	0	0	0	0	107.4
541	T	33.3	Very low	32.3	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	78%	0.781	S	S	*	*			trans	-135.7	107	164.7	-28.4	0	0	0	0	109.7
542	T	25	Very low	32.1	Very low	117 Å²	117	139.1 Å²	139.1	72%	0.718	78%	0.783	S	S	*	*			trans	-91.9	140.7	162.2	35.3	0	0	0	0	108.8
543	T	31.7	Very low	31.8	Very low	126 Å²	126	137.4 Å²	137.4	77%	0.773	78%	0.775	S	S	*	*			trans	159.7	140.3	153.1	30.3	0	0	0	0	106.8
544	T	31.8	Very low	31.7	Very low	134 Å²	134	141 Å²	141	82%	0.822	78%	0.782	S	S	*	*			cis	-164.9	144.6	14.7	1	0	0	0	0	108.4
545	T	27.5	Very low	31.8	Very low	146 Å²	146	140.7 Å²	140.7	90%	0.896	78%	0.781	S	S	*	*			trans	-84.2	135.5	171	16.7	0	0	0	0	112.1
546	S	34.2	Very low	31.7	Very low	122 Å²	122	137.8 Å²	137.8	85%	0.853	78%	0.777	S	S	*	*			trans	-162.4	122.3	150.6	60.9	0	0	0	0	106.1
547	G	28.6	Very low	32.2	Very low	66 Å²	66	138.6 Å²	138.6	68%	0.68	78%	0.779	S	S	*	*			cis	113.6	95.2	32	0	0	0	0	0	107.3
548	Y	33.8	Very low	32.1	Very low	247 Å²	247	143.4 Å²	143.4	97%	0.969	78%	0.779	S	S	*	*			trans	-151.4	127.2	152	-98.1	-75.5	0	0	0	109.7
549	A	32.6	Very low	32.5	Very low	82 Å²	82	143 Å²	143	68%	0.678	78%	0.777	S	S	*	*			trans	-94.6	178.8	-170.5	0	0	0	0	0	112.9
550	N	33.8	Very low	32.6	Very low	148 Å²	148	143.2 Å²	143.2	79%	0.791	78%	0.779	S	S	*	*			trans	91.1	137.7	161.6	-65.8	-17.7	0	0	0	116.9
551	L	31.2	Very low	33.2	Very low	125 Å²	125	142.7 Å²	142.7	65%	0.654	78%	0.778	S	S	*	*			cis	-174.6	153.3	-14.4	-154.8	78.2	0	0	0	105.7
552	Q	34.2	Very low	33.4	Very low	160 Å²	160	143.1 Å²	143.1	75%	0.748	78%	0.782	S	S	*	*			trans	70.3	148.4	158.6	-85	151.9	-0.7	0	0	119.7
553	Q	29.3	Very low	34	Very low	157 Å²	157	141.2 Å²	141.2	73%	0.734	79%	0.786	S	S	*	*			cis	177.2	153.3	-34.9	-127.6	-177.7	22.1	0	0	104.6
554	Q	34	Very low	34.3	Very low	164 Å²	164	144.7 Å²	144.7	77%	0.766	79%	0.793	S	S	*	*			trans	80.6	142	167.1	-54.2	169.7	37.1	0	0	117.4
555	Q	35.2	Very low	34.4	Very low	159 Å²	159	147.4 Å²	147.4	74%	0.743	80%	0.799	S	S	*	*			cis	-169	153.9	-20.3	-99.1	-158.4	27	0	0	104.9
556	P	34.1	Very low	34.9	Very low	117 Å²	117	144.3 Å²	144.3	76%	0.76	80%	0.795	S	S	*	*			trans	-94	134.9	175.6	34.7	-26.6	0	0	0	110.8
557	M	39.1	Very low	35.2	Very low	173 Å²	173	147.1 Å²	147.1	85%	0.852	80%	0.795	S	S	*	*			trans	-128.5	118.6	173.5	-80.1	-69.4	-84.5	0	0	112.8
558	R	33.7	Very low	35.8	Very low	220 Å²	220	150 Å²	150	83%	0.83	80%	0.801	S	S	*	*			trans	-79	158.9	162.4	-89.6	-179.8	174	171.8	-2.5	110.6
559	N	37	Very low	35.9	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	78%	0.782	S	S	*	*			trans	99.1	131.9	142.3	-75.2	-4.7	0	0	0	121.7
560	L	37.9	Very low	36.2	Very low	161 Å²	161	143.8 Å²	143.8	84%	0.843	79%	0.792	S	S	*	*			trans	99.2	153.3	149.7	-66.2	142.6	0	0	0	118.3
561	P	39.2	Very low	36.5	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	79%	0.79	S	S	*	*			cis	-137.6	-177.5	-36.5	37.2	-18	0	0	0	112.7
562	P	36.8	Very low	36.6	Very low	132 Å²	132	147.1 Å²	147.1	86%	0.857	80%	0.803	S	S	*	*			trans	-94.2	150.6	-163.6	36.3	-30	0	0	0	114.5
563	G	37.9	Very low	37.3	Very low	76 Å²	76	144.8 Å²	144.8	78%	0.784	80%	0.801	S	S	*	*			trans	-156.9	104.2	177.2	0	0	0	0	0	114.8
564	H	37.8	Very low	37.7	Very low	199 Å²	199	147.8 Å²	147.8	92%	0.921	81%	0.806	S	S	*	*			trans	29.8	116.7	155.8	-80.2	9.8	0	0	0	122.2
565	M	34.9	Very low	38.2	Very low	192 Å²	192	150.8 Å²	150.8	95%	0.946	81%	0.812	S	S	*	*			trans	-104.9	132.9	155.6	-82.3	-149.9	-99.9	0	0	111.1
566	G	38.2	Very low	38.5	Very low	80 Å²	80	150.8 Å²	150.8	83%	0.825	81%	0.811	S	S	*	*			trans	-110.6	123.4	160.7	0	0	0	0	0	110.4
567	H	39.2	Very low	39	Very low	182 Å²	182	157.8 Å²	157.8	84%	0.843	83%	0.833	S	S	*	*			trans	-73.3	173.5	160	-96.1	-60.4	0	0	0	110.1
568	P	42.9	Very low	38.9	Very low	125 Å²	125	157 Å²	157	81%	0.812	83%	0.833	S	S	*	*			cis	-135.6	165.2	22.8	32.9	-9.4	0	0	0	113.8
569	G	35.1	Very low	39.2	Very low	55 Å²	55	153.7 Å²	153.7	57%	0.567	83%	0.833	S	S	*	*				123.2	160.6	73.6	0	0	0	0	0	110.1
570	T	38.8	Very low	39.3	Very low	145 Å²	145	154.6 Å²	154.6	89%	0.89	84%	0.838	S	S	*	*			trans	80	139.5	175.9	72.5	0	0	0	0	116.4
571	S	40.1	Very low	39.4	Very low	107 Å²	107	154.2 Å²	154.2	75%	0.748	84%	0.838	S	S	*	*			cis	178.7	130.3	-18.6	42.8	0	0	0	0	105.2
572	Y	33.2	Very low	39.4	Very low	236 Å²	236	156.8 Å²	156.8	93%	0.925	85%	0.845	S	S	*	*			trans	-83.3	151.6	171.4	-85	-90	0	0	0	111.3
573	P	49.3	Very low	39.6	Very low	111 Å²	111	158.5 Å²	158.5	72%	0.721	84%	0.844	S	S	*	*			trans	-123.3	140.1	144	29	-14.1	0	0	0	113.1
574	R	36.7	Very low	39.8	Very low	219 Å²	219	164.4 Å²	164.4	83%	0.826	85%	0.848	S	S	*	*			trans	-54.1	149.4	166.3	-71.7	174.7	179.7	164.6	0.1	111.9
575	Y	45.5	Very low	39.9	Very low	227 Å²	227	161.7 Å²	161.7	89%	0.89	84%	0.842	S	S	*	*			trans	-121.2	122.6	146.6	-92.8	-85.7	0	0	0	110.3
576	H	41	Very low	40.3	Very low	159 Å²	159	159.2 Å²	159.2	74%	0.736	83%	0.834	S	S	*	*			trans	-68.5	130.9	158.6	-88.3	-86.5	0	0	0	109.1
577	H	43.9	Very low	40.5	Very low	264 Å²	264	166.4 Å²	166.4	100%	1.222	84%	0.835	S	S	*	*				-164.1	0	124.5	-112.3	-47.8	0	0	0	111.6

Retrieved 577 of 577 residues in 95 ms (Link to these results)

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